SCHEMBL6659601

SCHEMBL6659601

O=C(O)c1cc(OCc2ccc(C(=O)c3ccccc3)cc2)c(OCc2ccc(C(=O)c3ccccc3)cc2)c(OCc2ccc(C(=O)c3ccccc3)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.61
SRD5A2 P31213 2/20 0.58
RXRA P19793 7/20 0.55
RXRB P28702 6/20 0.55
RXRG P48443 5/20 0.55
HPGD P15428 1/20 0.55
ALDH1A1 P00352 2/20 0.54
HTT P42858 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
NR4A2 P43354 2/20 0.50
NR4A1 P22736 1/20 0.50
NR4A3 Q92570 1/20 0.50
PTGER1 P34995 1/20 0.49
PTGER4 P35408 1/20 0.49

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
SCHEMBL793724 0.89 MEN1 (0.65) SRD5A2RXRARXRBRXRGHPGD
SCHEMBL14660694 0.88 MEN1 (0.63) SRD5A2RXRARXRBRXRGHPGD
Hydrochloric Acid SCHEMBL514496 0.88 MEN1 (0.63) SRD5A2RXRARXRBRXRGHPGD
SCHEMBL6664749 0.86 LMNA (0.63) ATMRXRAHPGDALDH1A1HTT
SCHEMBL28236202 0.86 KDM4E (0.53) ATMSRD5A2HPGDSMN1; SMN2MEN1
SCHEMBL15673277 0.82 RXRA (0.62) SRD5A2RXRAHPGDSMN1; SMN2L3MBTL1
SCHEMBL17916639 0.82 NR4A2 (0.60) RXRARXRBRXRGHPGDKMT2A
SCHEMBL3599480 0.82 MEN1 (0.79) ATMSRD5A2RXRARXRBRXRG
SCHEMBL2227072 0.81 LMNA (0.56) HPGDMEN1KMT2ANR4A2NR4A1
SCHEMBL6661068 0.81 ATM (0.50) ATMSRD5A2HPGDALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888389-B1 PHOTOACTIVATABLE CHAIN TRANSFER AGENTS SURMODICS INC (US) 2004-08-04 EP disclosed
EP-0888389-A4 PHOTOACTIVATABLE CHAIN TRANSFER AGENTS SURMODICS INC (US) 2001-03-14 EP disclosed
US-5942555-A Photoactivatable chain transfer agents and semi-telechelic photoactivatable polymers prepared therefrom SURMODICS, INC. (US) 1999-08-24 US disclosed
EP-0888389-A1 PHOTOACTIVATABLE CHAIN TRANSFER AGENTS SurModics, Inc. (US) 1999-01-07 EP disclosed
WO-1997034935-A1 PHOTOACTIVATABLE CHAIN TRANSFER AGENTS BSI CORPORATION (US) 1997-09-25 WO disclosed