SCHEMBL24748837

SCHEMBL24748837

COc1cccc(-c2nc(OCC(=O)O)nn2O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
RECQL P46063 1/20 0.48
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
PTPN1 P18031 1/20 0.47
MAPK1 P28482 1/20 0.46
NPC1 O15118 3/20 0.46
TP53 P04637 2/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 1/20 0.46
GRK6 P43250 1/20 0.45
PPARD Q03181 3/20 0.44
FABP4 P15090 2/20 0.44
FABP5 Q01469 2/20 0.44
FFAR1 O14842 1/20 0.44
PPARA Q07869 2/20 0.44

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
SCHEMBL24748280 0.89 TSHR (0.49) RECQLNR1H2NR1H3MAPK1NPC1
SCHEMBL24407600 0.88 LMNA (0.53) LMNARECQLNR1H2NR1H3PTPN1
SCHEMBL24747532 0.88 PTGDR2 (0.46) LMNAALDH1A1KDM4EGRK6PPARD
SCHEMBL24748849 0.87 CSNK1D (0.46) RECQLNR1H2NR1H3PTPN1NPC1
SCHEMBL24748185 0.85 ALDH1A1 (0.49) PTPN1ALDH1A1PPARDPPARA
SCHEMBL24747463 0.83 ALOX15 (0.43) LMNAALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL24747535 0.83 MALT1 (0.46) LMNAKDM4ESMN1; SMN2PPARDEGLN1
SCHEMBL24748340 0.83 MALT1 (0.46) KDM4ESMN1; SMN2GRK6PPARDFFAR1
SCHEMBL24747898 0.78 MALT1 (0.42) NR1H2NR1H3ALDH1A1KDM4EMAPT
SCHEMBL24750701 0.78 KDM4E (0.48) LMNAALDH1A1KDM4EMAPTSMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382874-A1 [(5-PHENYL-1-HETEROARYL-1H-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-30 US disclosed
US-20220388971-A1 [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND SALTS THEREOF, CROP PROTECTION COMPOSITIONS COMPRISING THEM, METHODS FOR PRODUCING THEM AND USE THEREOF AS SAFENERS BAYER AKTIENGESELLSCHAFT (DE) 2022-12-08 US 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 (2 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-20230382874-A1 [(5-PHENYL-1-HETEROARYL-1H-TRIAZOL-3-YL)OXY] ACETIC ACID DERIVATIVES AS SAFENERS FOR THE PROTECTION OF USEFUL PLANTS AND CROP PLANTS CYP4Z1, PDK3, HACL2 LMNA 3320/4885RECQL 2554/4885NR1H2 1707/4885
US-20220388971-A1 [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACID DERIVATIVES AND SALTS THEREOF, CROP PROTECTION COMPOSITIONS COMPRISING THEM, METHODS FOR PRODUCING THEM AND USE THEREOF AS SAFENERS CYP4Z1, GSTO1, AADAC LMNA 3585/4885RECQL 2410/4885NR1H2 1779/4885

“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.