SCHEMBL9036962

SCHEMBL9036962

CC(C(=O)N1CCOCC1)n1ccc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
KMT2A Q03164 1/20 0.54
ALDH1A1 P00352 6/20 0.52
KDM4E B2RXH2 3/20 0.52
HPGD P15428 2/20 0.48
ALOX15 P16050 2/20 0.48
HSD17B10 Q99714 2/20 0.48
PLD1 Q13393 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.43
LMNA P02545 1/20 0.43
KDM1A O60341 1/20 0.42
NPY5R Q15761 1/20 0.42

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
SCHEMBL9036773 0.81 ALDH1A1 (0.55) GAAKMT2AALDH1A1KDM4EHPGD
SCHEMBL9038901 0.76 GAA (0.52) GAAKMT2AALDH1A1KDM4EHPGD
SCHEMBL57124 0.76 NPY5R (0.38) NPY5R
SCHEMBL55978 0.76 TP53 (0.40) GAAKMT2AALDH1A1HPGDSMN1; SMN2
SCHEMBL10203775 0.75 NOTUM (0.53) KMT2ATSHR
SCHEMBL526316 0.75 NOTUM (0.49) KMT2ATSHR
SCHEMBL57010 0.74 TRPV1 (0.38) KMT2AKDM4ELMNANPY5R
SCHEMBL9037965 0.73 ATM (0.46) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL14683431 0.73 NOTUM (0.47) KMT2ATSHRHTTLMNA
SCHEMBL10165373 0.73 NOTUM (0.47) KMT2ATSHR

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 11 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-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