SCHEMBL8387012

SCHEMBL8387012

C=C(C(=O)OC(C)Cl)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 5/20 0.46
MAPT P10636 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
NPSR1 Q6W5P4 3/20 0.46
XBP1 P17861 1/20 0.46
ALDH1A1 P00352 6/20 0.40
ELANE P08246 2/20 0.39
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 2/20 0.39
TP53 P04637 1/20 0.39
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
CYP3A4 P08684 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
HTT P42858 1/20 0.37
PAX8 Q06710 1/20 0.36

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
SCHEMBL4902023 0.85 TDP1 (0.50) ATMTDP1LMNAMAPTSMN1; SMN2
SCHEMBL11804658 0.84 ATM (0.49) ATMTDP1LMNAMAPTSMN1; SMN2
SCHEMBL28475093 0.79 MAPT (0.46) ATMTDP1LMNAMAPTSMN1; SMN2
SCHEMBL11808994 0.78 ATM (0.44) ATMTDP1LMNAMAPTSMN1; SMN2
SCHEMBL19210098 0.78 ATM (0.44) ATMTDP1LMNAMAPTSMN1; SMN2
SCHEMBL4909076 0.78 ESR1 (0.51) ATMTDP1LMNAMAPTSMN1; SMN2
SCHEMBL1594032 0.77 TSHR (0.59) TDP1LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL27610990 0.77 TSHR (0.59) TDP1LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL5672629 0.77 TSHR (0.59) TDP1LMNAMAPTSMN1; SMN2ALDH1A1
SCHEMBL11803070 0.77 ATM (0.43) ATMTDP1LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0910351-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-28 EP disclosed
EP-0907666-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. Searle & Co. (US) 1999-04-14 EP disclosed
WO-1997049736-A2 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed
WO-1997049387-A1 PARTICLES COMPRISING AMPHIPHILIC COPOLYMERS, HAVING A CROSS-LINKED SHELL DOMAIN AND AN INTERIOR CORE DOMAIN, USEFUL FOR PHARMACEUTICAL AND OTHER APPLICATIONS G.D. SEARLE AND CO. (US) 1997-12-31 WO disclosed