SCHEMBL9035701

SCHEMBL9035701

Cc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1CCO

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.81
CNR1 P21554 7/20 0.81
MEN1 O00255 1/20 0.81
NR1I2 O75469 1/20 0.81
ALDH1A1 P00352 1/20 0.81
CYP1A2 P05177 1/20 0.81
MAPT P10636 1/20 0.81
HPGD P15428 1/20 0.81
TSHR P16473 1/20 0.81
MAPK1 P28482 1/20 0.81
CYP2C19 P33261 1/20 0.81
KMT2A Q03164 1/20 0.81
NR1H4 Q96RI1 1/20 0.81
SLC6A3 Q01959 1/20 0.76

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
SCHEMBL497044 0.90 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL29989454 0.87 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL10093010 0.86 CNR2 (0.81) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL29362163 0.86 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL16344141 0.86 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL9691079 0.86 CNR2 (0.80) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL14762043 0.85 CNR2 (0.78) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL9037761 0.83 CNR1 (0.82) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL10669175 0.82 CNR1 (1.00) CNR2CNR1
SCHEMBL15142796 0.82 CNR2 (0.69) CNR2CNR1MEN1NR1I2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445781-B1 3-Arylcarbonyl-1-aminoalkyl-1H-indole containing antiglaucoma compositions STERLING WINTHROP INC (US) 1996-01-31 EP disclosed
EP-0171037-B1 3-CARBONYL-1-AMINOALKYL-1H-INDOLES USEFUL AS ANALGESICS AND PREPARATION THEREOF STERLING WINTHROP INC. (US) 1992-06-17 EP disclosed
EP-0445781-A1 3-Arylcarbonyl-1-aminoalkyl-1H-indole containing antiglaucoma compositions STERLING WINTHROP INC. (US) 1991-09-11 EP disclosed
US-5013837-A Treatment of glaucoma STERLING DRUG INC. (US) 1991-05-07 US disclosed
US-5013732-A Analgesics STERLING DRUG INC. (US) 1991-05-07 US disclosed
US-4978664-A Analgesic, anti-rheumatic, and anti-inflammatory agent STERLING DRUG INC. (US) 1990-12-18 US disclosed
US-4973587-A 3-arylcarbonyl-1-aminoalkyl-1H-indole-containing antiglaucoma method STERLING DRUG INC. (US) 1990-11-27 US disclosed
US-4885295-A ANALGESICS; ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES STERLING DRUG INC. (US) 1989-12-05 US disclosed
US-RE32761-E ANALGESICS, ANTIRHEUMATIC AND ANTIINFLAMMATORY AGENT STERLING DRUG INC. (US) 1988-10-04 US disclosed
US-4634776-A ANALGESIC, ANTIRHEUMATIC, ANTIINFLAMMATORY STERLING DRUG, INC. (US) 1987-01-06 US disclosed
US-4581354-A ANALGESICS;ANTI-RHEUMATIC AND ANTI-INFLAMMATORY AGENTS STERLING DRUG INC. (US) 1986-04-08 US disclosed
EP-0171037-A2 3-Carbonyl-1-aminoalkyl-1H-indoles useful as analgesics and preparation thereof STERLING WINTHROP INC. (US) 1986-02-12 EP disclosed