SCHEMBL8618325

SCHEMBL8618325

CON=C(C(=O)O)c1ccccc1COc1cc(C)cc(C)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.58
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
PTPRC P08575 1/20 0.39
PTPN1 P18031 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PTGER4 P35408 1/20 0.38
KDM4C Q9H3R0 1/20 0.37
TSHR P16473 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL8618321 1.00 HIF1A (0.58) HIF1AMAPTHPGDKDM4EALDH1A1
SCHEMBL8621336 0.90 HIF1A (0.65) HIF1AMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL8621331 0.90 HIF1A (0.65) HIF1AMAPTALDH1A1HTTSMN1; SMN2
SCHEMBL8618297 0.89 HIF1A (0.57) HIF1AMAPTHPGDKDM4EALDH1A1
SCHEMBL8618301 0.89 HIF1A (0.57) HIF1AMAPTHPGDKDM4EALDH1A1
SCHEMBL5022336 0.89 HIF1A (0.57) HIF1AMAPTHPGDALDH1A1HTT
SCHEMBL8624119 0.89 HIF1A (0.57) HIF1AMAPTHPGDALDH1A1HTT
SCHEMBL8623305 0.88 HIF1A (0.65) HIF1AKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL8623308 0.88 HIF1A (0.65) HIF1AKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL8372645 0.87 HIF1A (0.57) HIF1AMAPTHPGDKDM4EALDH1A1

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