SCHEMBL166328

SCHEMBL166328

O=C(O)Cn1c(-c2ccc(Cl)cc2)n[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
APOBEC3G Q9HC16 3/20 0.48
GFER P55789 2/20 0.48
LMNA P02545 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
POLB P06746 2/20 0.45
TSHR P16473 1/20 0.45
APEX1 P27695 1/20 0.45
HSD17B10 Q99714 1/20 0.45
AKR1B10 O60218 4/20 0.42
CA9 Q16790 2/20 0.41
TYMP P19971 1/20 0.41
MAPK11 Q15759 1/20 0.41
MAPK14 Q16539 1/20 0.41
CA12 O43570 1/20 0.40
ALPL P05186 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL168320 0.85 APOBEC3G (0.45) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL15143990 0.83 ALDH1A1 (0.53) MAPTALDH1A1HPGDAPOBEC3GLMNA
SCHEMBL8233155 0.80 APOBEC3G (0.68) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL8233143 0.80 ALDH1A1 (0.58) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL9354368 0.79 ALDH1A1 (0.70) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL19570447 0.79 APOBEC3G (0.40) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL8232792 0.77 APOBEC3G (0.48) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL8227328 0.77 APOBEC3G (0.51) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL2410806 0.77 MAPT (0.51) MAPTALDH1A1HPGDNPSR1APOBEC3G
SCHEMBL15143991 0.76 GRK6 (0.50) MAPTALDH1A1HSD17B10AKR1B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 112 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021259852-A1 PROCESS FOR PREPARING 5-(ALKOXYCARBONYL)-AND 5-(CARBOXAMIDE)-1-ARYL-1,2,4-TRIAZOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2021-12-30 WO disclosed
US-11091463-B2 Amide-substituted pyridinyltriazole derivatives and uses thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-08-17 US disclosed
EP-3452463-B1 AMIDE-SUBSTITUTED PYRIDINYLTRIAZOLE DERIVATIVES AND USES THEREOF Bayer Pharma AG (DE) 2021-03-24 EP disclosed
US-10927098-B2 Hydroxyalkyl-substituted triazole derivatives and uses thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-02-23 US disclosed
US-10815205-B2 Amide-substituted phenyltriazole derivatives and uses thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-10-27 US disclosed
US-10800746-B2 Oxoalkyl-substituted phenyltriazole derivatives and uses thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-10-13 US disclosed
US-20200299271-A1 METHOD FOR PRODUCING 5-HYDROXYALKYL-SUBSTITUTED 1-PHENYL-1,2,4- TRIAZOLE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-09-24 US disclosed
US-10703742-B2 Method for producing 5-hydroxyalkyl-substituted 1-phenyl-1,2,4-triazole derivatives BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-07-07 US disclosed
EP-3452457-B1 OXOALKYL-SUBSTITUTED PHENYLTRIAZOLE DERIVATIVES AND USES THEREOF Bayer Pharma AG (DE) 2020-03-18 EP disclosed
EP-3452470-B1 AMIDE-SUBSTITUTED PHENYLTRIAZOLE DERIVATIVES AND USES THEREOF Bayer Pharma AG (DE) 2020-03-18 EP disclosed
WO-2011023703-A1 HETEROCYCLIC-SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-03-03 WO disclosed
WO-2011023703-A1 HETEROCYCLIC-SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-03-03 WO disclosed
US-20100261771-A1 SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-10-14 US disclosed
US-20100261771-A1 SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-10-14 US disclosed
US-20100261771-A1 SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-10-14 US disclosed
WO-2010105770-A1 SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-09-23 WO disclosed
WO-2010105770-A1 SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-09-23 WO disclosed
WO-2010105750-A1 TRIAZOLE DERIVATIVES AS VASOPRESSIN-RECEPTOR INHIBITORS FOR TREATING CARDIAC INSUFFICIENCY BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-09-23 WO disclosed
WO-2010105750-A1 TRIAZOLE DERIVATIVES AS VASOPRESSIN-RECEPTOR INHIBITORS FOR TREATING CARDIAC INSUFFICIENCY BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-09-23 WO disclosed
WO-2010063402-A1 SUBSTITUTED BENZYL AND PHENYLSULFONYL TRIAZOLONES, AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10927098-B2 Hydroxyalkyl-substituted triazole derivatives and uses thereof LIPG, PLIN3, FABP3 MAPT 4705/4885ALDH1A1 530/4885HPGD 545/4885
US-10815205-B2 Amide-substituted phenyltriazole derivatives and uses thereof AADAC, GLS, NAT1 MAPT 1239/4885ALDH1A1 832/4885HPGD 1261/4885
US-10800746-B2 Oxoalkyl-substituted phenyltriazole derivatives and uses thereof AADAC, REN, PKD1 MAPT 3193/4885ALDH1A1 701/4885HPGD 1483/4885
US-20100261771-A1 SUBSTITUTED 2-ACETAMIDO-5-ARYL-1,2,4-TRIAZOLONES AND USE THEREOF AADAC, NAT1, TNNT2 MAPT 4612/4885ALDH1A1 173/4885HPGD 782/4885
US-10703742-B2 Method for producing 5-hydroxyalkyl-substituted 1-phenyl-1,2,4-triazole derivatives CYP1A1, H1-3, H1-0 MAPT 3843/4885ALDH1A1 165/4885HPGD 2783/4885
US-11091463-B2 Amide-substituted pyridinyltriazole derivatives and uses thereof AADAC, GLS, PDXK MAPT 2155/4885ALDH1A1 1295/4885HPGD 706/4885
US-20200299271-A1 METHOD FOR PRODUCING 5-HYDROXYALKYL-SUBSTITUTED 1-PHENYL-1,2,4- TRIAZOLE DERIVATIVES CYP1A1, H1-3, H1-0 MAPT 3843/4885ALDH1A1 165/4885HPGD 2783/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.