SCHEMBL11095090

SCHEMBL11095090

CC1C(=O)Nc2c(Oc3ccccc3Cl)cccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.39
SLC6A4 P31645 4/20 0.39
SLC6A3 Q01959 4/20 0.39
HTR1A P08908 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
CACNB4 O00305 1/20 0.38
CACNA1A O00555 1/20 0.38
CACNA1G O43497 1/20 0.38
CACNG3 O60359 1/20 0.38
CACNA1F O60840 1/20 0.38
CACNA1H O95180 1/20 0.38
CACNB3 P54284 1/20 0.38
CACNA2D1 P54289 1/20 0.38
CACNG7 P62955 1/20 0.38
CACNA1B Q00975 1/20 0.38
CACNA1D Q01668 1/20 0.38
CACNB1 Q02641 1/20 0.38
CACNG1 Q06432 1/20 0.38
CACNB2 Q08289 1/20 0.38
CACNA1S Q13698 1/20 0.38

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
SCHEMBL24112933 0.85 PGR (0.49) SLC6A3SMN1; SMN2CACNB4CACNA1ACACNA1G
SCHEMBL24112226 0.85 PGR (0.49) SLC6A3SMN1; SMN2CACNB4CACNA1ACACNA1G
SCHEMBL11093677 0.82 CACNB4 (0.36) SLC6A2SLC6A4SLC6A3HTR1ASMN1; SMN2
SCHEMBL11123362 0.71 HPGD (0.38) SLC6A2SLC6A4SLC6A3HTR1ASMN1; SMN2
SCHEMBL11090819 0.71 HTR1A (0.35) SLC6A2SLC6A4HTR1ASMN1; SMN2CACNB4
SCHEMBL11094086 0.70 HTR1A (0.34) HTR1AMEN1USP2KMT2AHTR1D
SCHEMBL24112725 0.70 ALDH1A1 (0.43) PGRDAOMEN1KMT2AHTR2C
SCHEMBL24112230 0.70 ALDH1A1 (0.43) PGRDAOMEN1KMT2AHTR2C
SCHEMBL4408041 0.70 PGR (0.40) HTR1ASMN1; SMN2CACNB4CACNA1ACACNA1G
SCHEMBL20939667 0.68 PDE7A (0.40) SMN1; SMN2PGR

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
US-4472433-A Phenoxyphenyl acetic acids and their medicinal use FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US disclosed
EP-0008226-B1 PHENYL-ALKANOIC ACID DERIVATIVES, THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-02 EP disclosed
EP-0008226-A2 Phenyl-alkanoic acid derivatives, the preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-02-20 EP disclosed