SCHEMBL11445600

SCHEMBL11445600

COc1ccc(Cl)cc1C(=O)NCc1ccc(Cl)c(C(=O)O)c1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.63
HPGD P15428 2/20 0.63
PPARA Q07869 1/20 0.60
DNMT3A Q9Y6K1 1/20 0.58
MRGPRX4 Q96LA9 2/20 0.57
APEX1 P27695 3/20 0.57
HDAC1 Q13547 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
ALDH1A1 P00352 1/20 0.53
NLRP3 Q96P20 1/20 0.53

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
SCHEMBL11445605 0.89 LMNA (0.60) LMNAHPGDPPARADNMT3AMRGPRX4
SCHEMBL11445616 0.88 DNMT3A (0.71) LMNADNMT3AHDAC1HDAC6NLRP3
SCHEMBL23657593 0.86 LMNA (0.72) LMNAHPGDPPARADNMT3AHDAC1
SCHEMBL11464602 0.85 PTGER4 (0.69) LMNAHPGDPPARADNMT3AHDAC1
SCHEMBL11516368 0.84 LMNA (0.68) LMNAHPGDPPARADNMT3AHDAC1
SCHEMBL11356211 0.83 LMNA (0.64) LMNAHPGDPPARADNMT3AHDAC1
SCHEMBL11445783 0.81 CA1 (0.57) LMNAHPGDMRGPRX4APEX1ALDH1A1
SCHEMBL11488803 0.81 PPARA (0.67) LMNAPPARADNMT3AHDAC1HDAC6
SCHEMBL13812752 0.80 LMNA (0.60) LMNAHPGDPPARADNMT3AAPEX1
SCHEMBL29617795 0.80 LMNA (0.62) LMNAHPGDPPARADNMT3AHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4182775-A Benzoic acids and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1980-01-08 US disclosed