SCHEMBL9469064

SCHEMBL9469064

COc1ccc(N)c(C2Cc3ccccc3N2)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.45
AR P10275 1/20 0.44
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 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
SCHEMBL9469409 0.84 HTR2A (0.45) HTR2A
SCHEMBL9470035 0.81 CTSD (0.40) ALDH1A1
SCHEMBL9469090 0.79 AR (0.47) HTR2AARALDH1A1MAPTRAB9A
SCHEMBL9469797 0.79 AR (0.47) ARALDH1A1MAPTKDM4EMEN1
SCHEMBL9469811 0.79 AR (0.47) HTR2AARALDH1A1MAPTRAB9A
SCHEMBL9469119 0.78 AR (0.54) ARMAPTKDM4EMEN1GAA
SCHEMBL13964738 0.77 KDM4E (0.53) ARALDH1A1MAPTKDM4EMEN1
SCHEMBL11699617 0.71 SLC6A2 (0.44) ARKDM4EMEN1GAAKMT2A
SCHEMBL9469084 0.70 AR (0.47) ARALDH1A1MAPTGAA
SCHEMBL9469546 0.70 AR (0.47) ARMAPTKDM4EMEN1GAA

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