SCHEMBL15414513

SCHEMBL15414513

CCCCOC(=O)c1n[c]nc(N2CCCCC2)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
TP53 P04637 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.38
LMNA P02545 3/20 0.38
NPSR1 Q6W5P4 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 3/20 0.35
ESR1 P03372 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL15415231 0.89 L3MBTL1 (0.47) MAPTSMN1; SMN2TP53KMT2ANPC1
SCHEMBL15415214 0.80 OPRK1 (0.38) MAPTSMN1; SMN2TP53NPC1RAB9A
SCHEMBL15414949 0.76 CHRM3 (0.36) MAPTSMN1; SMN2L3MBTL1KDM4ECYP3A4
SCHEMBL15416134 0.73 MAPT (0.41) MAPTSMN1; SMN2TP53KMT2ANPC1
SCHEMBL15415190 0.66 CHRM3 (0.40) SMN1; SMN2LMNAKDM4EHSD17B10CYP1A2
SCHEMBL8523468 0.66 SMN1; SMN2 (0.66) MAPTSMN1; SMN2TP53KMT2ANPC1
SCHEMBL15415100 0.66 KMT2A (0.56) MAPTSMN1; SMN2TP53KMT2ANPC1
SCHEMBL15415808 0.65 ALDH1A1 (0.38) MAPTSMN1; SMN2TP53NPC1RAB9A
SCHEMBL11492059 0.64 SMN1; SMN2 (0.67) MAPTSMN1; SMN2TP53KMT2ANPC1
SCHEMBL1826048 0.64 SMN1; SMN2 (0.67) MAPTSMN1; SMN2TP53KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080127-B1 IMIDAZOPYRIMIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-06-24 EP disclosed
EP-3080128-B1 IMIDAZOPYRIDAZINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-06-24 EP disclosed
EP-3080123-B1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-06-17 EP disclosed
EP-3080130-B1 TRIAZOLOPYRIDAZINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-06-03 EP disclosed
EP-3080112-B1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-06-03 EP disclosed
EP-3080129-B1 IMIDAZOTRIAZINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-06-03 EP disclosed
EP-3303337-B1 FUSED TRICYCLIC IMIDAZO PYRAZINES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-05-27 EP disclosed
EP-3080111-B1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-05-27 EP disclosed
EP-3080118-B1 TETRAHYDROIMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SRL (BE) 2020-03-04 EP disclosed
US-10472362-B2 Fused tricyclic imidazo pyrazines as modulators of TNF activity UCB BIOPHARMA SPRL (BE) 2019-11-12 US disclosed
US-20160297837-A1 Fused Imidazole and Pyrazole Derivatives As Modulators of TNF Activity EVOTEC (UK) LTD. (GB) 2016-10-13 US disclosed
US-20160297818-A1 Purine Derivatives As Modulators of TNF Activity UCB BIOPHARMA SPRL (BE) 2016-10-13 US disclosed
US-20160297799-A1 Benzotriazole Derivatives as Modulators of TNF Activity UCB BIOPHARMA SPRL (BE) 2016-10-13 US disclosed
US-20160289228-A1 Tetrahydroimidazopyridine Derivatives as Modulators of TNF Activity UCB BIOPHARMA SPRL (BE) 2016-10-06 US disclosed
US-9309243-B2 Imidazopyridine derivatives as modulators of TNF activity UCB BIOPHARMA SPRL (BE) 2016-04-12 US disclosed
US-20150203486-A1 Imidazopyridine Derivatives as Modulators of TNF Activity UCB Biopharma SPRL a corporation 2015-07-23 US disclosed
WO-2015086523-A1 FUSED BICYCLIC HETEROAROMATIC DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2015-06-18 WO disclosed
WO-2015086506-A1 FUSED IMIDAZOLE AND PYRAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2015-06-18 WO disclosed
EP-2872508-A1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SPRL (BE) 2015-05-20 EP disclosed
WO-2014009295-A1 IMIDAZOPYRIDINE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB PHARMA S.A. (BE) 2014-01-16 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 (6 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-20150203486-A1 Imidazopyridine Derivatives as Modulators of TNF Activity TNF, TNFRSF1A, IL1A MAPT 1715/4885SMN1; SMN2 411/4885TP53 1808/4885
US-20160297818-A1 Purine Derivatives As Modulators of TNF Activity TNF, TNFRSF1A, PNP MAPT 2200/4885SMN1; SMN2 494/4885TP53 2091/4885
US-20160289228-A1 Tetrahydroimidazopyridine Derivatives as Modulators of TNF Activity TNF, TNFRSF1A, NFKBIA MAPT 873/4885SMN1; SMN2 278/4885TP53 1105/4885
US-20160297837-A1 Fused Imidazole and Pyrazole Derivatives As Modulators of TNF Activity TNF, TNFRSF1A, TNFRSF9 MAPT 913/4885SMN1; SMN2 1329/4885TP53 483/4885
US-10472362-B2 Fused tricyclic imidazo pyrazines as modulators of TNF activity TNF, TNFRSF1A, TNFRSF9 MAPT 1718/4885SMN1; SMN2 1346/4885TP53 397/4885
US-20160297799-A1 Benzotriazole Derivatives as Modulators of TNF Activity TNF, NFKBIA, TNFRSF1A MAPT 258/4885SMN1; SMN2 1030/4885TP53 1659/4885

“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.