SCHEMBL11118950

SCHEMBL11118950

CCc1ccc(Oc2ccc(N)cc2Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
PDE7A Q13946 1/20 0.49
HTR2A P28223 1/20 0.47
SLC6A4 P31645 1/20 0.47
FFAR1 O14842 2/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GLA P06280 1/20 0.42
ACACB O00763 2/20 0.42
PNLIP P16233 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL8417842 0.90 PDE7A (0.52) SMN1; SMN2PDE7AHTR2ASLC6A4FFAR1
SCHEMBL4318630 0.84 PDE7A (0.63) SMN1; SMN2PDE7AHTR2ASLC6A4MAPT
SCHEMBL4414860 0.83 FFAR1 (0.60) SMN1; SMN2HTR2ASLC6A4FFAR1MAPT
SCHEMBL30026989 0.82 SMN1; SMN2 (0.48) SMN1; SMN2HTR2ASLC6A4MAPTNPC1
SCHEMBL5583563 0.81 TEAD4 (0.57) SMN1; SMN2PDE7AHTR2ASLC6A4MAPT
SCHEMBL1147436 0.81 PDE7A (0.53) SMN1; SMN2PDE7AHTR2ASLC6A4MAPT
SCHEMBL8414986 0.81 ACACB (0.57) SMN1; SMN2PDE7AFFAR1RAB9AGLA
SCHEMBL29553590 0.81 MAOA (0.61) SMN1; SMN2PDE7AHTR2ASLC6A4FFAR1
SCHEMBL554722 0.81 MAOA (0.61) SMN1; SMN2PDE7AHTR2ASLC6A4FFAR1
SCHEMBL17676584 0.81 FFAR1 (0.43) SMN1; SMN2HTR2ASLC6A4FFAR1GLA

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
EP-0067381-B1 ANILIDES, PROCESS FOR THEIR PREPARATION AND HERBICIDES CONTAINING THEM BASF Aktiengesellschaft (DE) 1984-03-21 EP disclosed
EP-0067381-A1 Anilides, process for their preparation and herbicides containing them BASF Aktiengesellschaft (DE) 1982-12-22 EP disclosed