SCHEMBL1572836

SCHEMBL1572836

COc1c(C)c(C(=O)c2ccc(N)c(C(=O)O)c2)n2cccc(OCc3ccccc3)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 2/20 0.41
▸ ATM Q13315 1/20 0.40
▸ PTGER1 P34995 3/20 0.40
▸ ATP4A P20648 2/20 0.39
▸ ATP4B P51164 2/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ RXRB P28702 1/20 0.39
▸ RXRG P48443 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMPD1 P17405 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ CTSV O60911 1/20 0.37
▸ CTSL P07711 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
SCHEMBL4496560 0.93 HPGD (0.41) RXRAATMATP4AATP4BNPC1
SCHEMBL4496071 0.88 KMT2A (0.38) HPGDSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL1573301 0.88 KMT2A (0.38) HPGDSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL1572906 0.84 DDB1 (0.36) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL1572736 0.84 KMT2A (0.35) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL1573244 0.84 CTSV (0.39) RXRAATMPTGER1ATP4AATP4B
SCHEMBL1573188 0.84 ALDH1A1 (0.35) ATMNPC1SMN1; SMN2MEN1KMT2A
SCHEMBL1572804 0.84 KMT2A (0.37) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL4496523 0.83 CTSD (0.39) MEN1KMT2AHDAC1HDAC8HDAC6
SCHEMBL4507727 0.83 PLA2G1B (0.40) HPGDSMN1; SMN2MEN1KMT2AKDM4E

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-2018165-B1 FGF-PECEPTOR AGONIST DIMERIC COMPOUNDS SANOFI AVENTIS (FR) 2011-04-13 — — EP disclosed
EP-2018165-A1 FGF-PECEPTOR AGONIST DIMERIC COMPOUNDS Sanofi-Aventis (FR) 2009-01-28 — — EP disclosed
WO-2007080325-A1 FGF-RECEPTOR AGONIST DIMERIC COMPOUNDS SANOFI-AVENTIS (FR) 2007-07-19 — — WO disclosed
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