SCHEMBL9469366

SCHEMBL9469366

CNc1ccc(Cl)cc1C1Cc2ccccc2N1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.44
GAA P10253 2/20 0.34
MAPT P10636 1/20 0.34
DRD2 P14416 3/20 0.33
HRH1 P35367 3/20 0.33
DRD4 P21917 2/20 0.33
HTR2C P28335 2/20 0.33
TRPM5 Q9NZQ8 2/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
CYP2C19 P33261 1/20 0.33
THPO P40225 1/20 0.33
HIF1A Q16665 1/20 0.33
NPC1 O15118 1/20 0.33
MTOR P42345 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL9469019 0.81 RAB9A (0.46) ARGAAMAPTTSHRNPC1
SCHEMBL9469656 0.79 EPHX2 (0.45) ARGAAMAPTKDM4E
SCHEMBL9469797 0.79 AR (0.47) ARGAAMAPTTRPM5CYP3A4
SCHEMBL3247160 0.70 PRCP (0.57) GAAMAPTHRH1HTR2CALDH1A1
SCHEMBL9469027 0.69 HTR3E (0.39) ARGAAMAPTTRPM5KDM4E
SCHEMBL21892439 0.68 AR (0.43) ARGAAMAPTTSHRNPC1
SCHEMBL8331546 0.67 FADS1 (0.36) GAAMAPTHRH1HTR2CCYP2D6
SCHEMBL9469119 0.65 AR (0.54) ARGAAMAPTCYP3A4CYP2D6
SCHEMBL9470035 0.65 CTSD (0.40) DRD2HTR2CALDH1A1
SCHEMBL29779937 0.64 PRCP (0.55) ARGAAMAPTNPC1KDM4E

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
US-5166170-A 2-(AMINOARYL) INDOLES AND INDOLINES AS TOPICAL ANTIINFLAMMATORY AGENTS FOR THE TREATMENT OF SKIN DISORDERS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-11-24 US claimed
US-5214059-A Dermatitis, psoriasis HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-05-25 US disclosed
US-5166170-A 2-(AMINOARYL) INDOLES AND INDOLINES AS TOPICAL ANTIINFLAMMATORY AGENTS FOR THE TREATMENT OF SKIN DISORDERS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-11-24 US disclosed
EP-0406734-A2 2-(Aminoaryl)indoles and indolines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-01-09 EP disclosed