SCHEMBL8617535

SCHEMBL8617535

CON=C(C(=O)OC)c1ccccc1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.52
ALDH1A1 P00352 2/20 0.48
ALOX15 P16050 1/20 0.48
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KMT2A Q03164 1/20 0.43
HTT P42858 1/20 0.41
F2 P00734 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
AKR1C3 P42330 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
SCHEMBL8613161 0.85 HIF1A (0.50) HIF1AALDH1A1ALOX15KDM4EHSD17B10
SCHEMBL29810082 0.83 HIF1A (0.51) HIF1AHPGDKMT2A
SCHEMBL7040691 0.83 HIF1A (0.51) HIF1AHPGDKMT2A
SCHEMBL29883529 0.83 HIF1A (0.51) HIF1AHPGDKMT2A
SCHEMBL7119395 0.83 LMNA (0.55) HIF1AALDH1A1ALOX15KDM4EHPGD
SCHEMBL6705433 0.83 LMNA (0.55) HIF1AALDH1A1ALOX15KDM4EHPGD
SCHEMBL29445316 0.83 HIF1A (0.51) HIF1AHPGDKMT2A
SCHEMBL6705432 0.83 LMNA (0.55) HIF1AALDH1A1ALOX15KDM4EHPGD
SCHEMBL6155893 0.83 HIF1A (0.51) HIF1AHPGDKMT2A
SCHEMBL3747106 0.83 HIF1A (0.51) HIF1AHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5719171-A INSECTICIDES; MITICIDES; NEMATOCIDES; FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-02-17 US disclosed
US-5594020-A FUNGICIDE BASF AKTIENGESELLSCHAFT (DE) 1997-01-14 US disclosed
EP-0621277-A2 Diarylderivatives and their use for the protection of plants BASF Aktiengesellschaft (DE) 1994-10-26 EP disclosed