SCHEMBL8618307

SCHEMBL8618307

CCON=C(C(=O)Cl)c1ccccc1COc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 7/20 0.48
NR4A2 P43354 2/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CAPN1 P07384 1/20 0.40
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
PTPRC P08575 1/20 0.40
PTPN1 P18031 1/20 0.40
TSHR P16473 1/20 0.38
MAPK10 P53779 1/20 0.38

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
SCHEMBL8618303 1.00 HIF1A (0.48) HIF1ANR4A2TP53HTTMAOA
SCHEMBL8618330 0.90 HIF1A (0.50) HIF1ANR4A2TP53HTTMAOA
SCHEMBL8618332 0.90 HIF1A (0.50) HIF1ANR4A2TP53HTTMAOA
SCHEMBL8400528 0.88 HIF1A (0.49) HIF1ANR4A2TP53HTTMAOA
SCHEMBL8400532 0.88 HIF1A (0.49) HIF1ANR4A2TP53HTTMAOA
SCHEMBL8624082 0.87 HIF1A (0.62) HIF1ANR4A2TP53HTTMAOA
SCHEMBL8624085 0.87 HIF1A (0.62) HIF1ANR4A2TP53HTTMAOA
SCHEMBL8617460 0.85 HIF1A (0.54) HIF1AMAOBMRGPRX4
SCHEMBL8617459 0.85 HIF1A (0.54) HIF1AMAOBMRGPRX4
SCHEMBL8624032 0.84 HIF1A (0.48) HIF1ANR4A2TP53HTTNPC1

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
EP-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed