SCHEMBL10693157

SCHEMBL10693157

COc1ccc(C2OC(=O)c3ccc(N(C)C)cc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
PDE4D Q08499 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
NR3C1 P04150 1/20 0.43
MAPT P10636 4/20 0.41
HPGD P15428 2/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
MAOB P27338 4/20 0.40
CYP3A4 P08684 1/20 0.40
CYP19A1 P11511 1/20 0.40
RPS6KA2 Q15349 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
TP53 P04637 1/20 0.39
MAOA P21397 1/20 0.39

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
SCHEMBL10692102 0.90 LMNA (0.44) LMNAPDE4DALDH1A1NR3C1MAPT
SCHEMBL10691917 0.89 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1GAAKMT2A
SCHEMBL11070301 0.84 ATM (0.48) LMNAPDE4DALDH1A1KDM4EMEN1
SCHEMBL4686888 0.79 ALDH1A1 (0.58) LMNAALDH1A1KDM4EMEN1GAA
SCHEMBL11543103 0.79 ALDH1A1 (0.67) LMNAALDH1A1NR3C1MAPTHPGD
SCHEMBL339072 0.77 ALDH1A1 (0.47) ALDH1A1KDM4EMEN1GAAKMT2A
SCHEMBL10693119 0.76 ALDH1A1 (0.46) LMNAALDH1A1KDM4EMEN1GAA
SCHEMBL337709 0.76 ALDH1A1 (0.67) ALDH1A1KDM4EMEN1GAAKMT2A
SCHEMBL10693011 0.74 CDK1 (0.50) PDE4DALDH1A1KDM4EGAANR3C1
SCHEMBL11068781 0.74 ATM (0.43) ALDH1A1KDM4EMAPTHPGDMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4732991-A Substituted phthalides HILTON DAVIS CHEMICAL CO. (US) 1988-03-22 US disclosed
US-4595768-A 3-(substituted phenyl)phthalides THE HILTON-DAVIS CHEMICAL CO. (US) 1986-06-17 US disclosed