SCHEMBL7316113

SCHEMBL7316113

CN[C@H](C)Cc1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.63
SLC18A2 Q05940 1/20 0.63
SIGMAR1 Q99720 1/20 0.63
SLC6A4 P31645 4/20 0.60
SLC6A2 P23975 2/20 0.57
SLC6A3 Q01959 2/20 0.57
ACACB O00763 1/20 0.50
CYP2D6 P10635 1/20 0.47

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
SCHEMBL178533 1.00 TAAR1 (0.63) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
SCHEMBL21286088 1.00 TAAR1 (0.63) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
Hydrochloric Acid SCHEMBL23524375 0.98 TAAR1 (0.61) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
SCHEMBL13996924 0.81 CYP1A2 (0.66) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
SCHEMBL11162290 0.81 SLC6A2 (0.55) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
SCHEMBL178625 0.80 TAAR1 (0.65) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
SCHEMBL6077438 0.80 SLC6A2 (0.54) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
SCHEMBL10076448 0.80 TAAR1 (0.65) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
SCHEMBL765297 0.80 TAAR1 (0.65) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2
Hydrochloric Acid SCHEMBL7343144 0.79 SLC6A2 (0.59) TAAR1SLC18A2SIGMAR1SLC6A4SLC6A2

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
WO-2000054773-A1 DOPAMINE AGONISTS IN COMBINATION WITH NITRIC OXIDE DONORS, COMPOSITIONS AND METHODS OF USE NITROMED, INC. (US) 2000-09-21 WO claimed
EP-3841085-B1 NBOME TEST UNIV SYDNEY TECHNOLOGY (AU) 2026-05-06 EP disclosed
EP-3752497-B1 P300/CBP HAT INHIBITORS CONSTELLATION PHARMACEUTICALS INC (US) 2024-07-17 EP disclosed
US-11761954-B2 NBOMe test UNIVERSITY OF TECHNOLOGY SYDNEY 2023-09-19 US disclosed
WO-2019161162-A1 P300/CBP HAT INHIBITORS CONSTELLATION PHARMACEUTICALS, INC. (US) 2019-08-22 WO disclosed
WO-2000054773-A1 DOPAMINE AGONISTS IN COMBINATION WITH NITRIC OXIDE DONORS, COMPOSITIONS AND METHODS OF USE NITROMED, INC. (US) 2000-09-21 WO disclosed
US-4626549-A Treatment of obesity with aryloxyphenylpropylamines ELI LILLY AND COMPANY (US) 1986-12-02 US disclosed
US-4521421-A USING 2-AMINO-OCTAHYDROPYRIMIDO(4,5-G)QUINOLINE COMPOUND ELI LILLY AND COMPANY (US) 1985-06-04 US disclosed
US-4314081-A ANTIDEPRESSANTS ELI LILLY AND COMPANY (US) 1982-02-02 US disclosed
US-4194009-A ANTIDEPRESSANT ELI LILLY AND COMPANY (US) 1980-03-18 US disclosed
US-4018895-A Aryloxyphenylpropylamines in treating depression ELI LILLY AND COMPANY (US) 1977-04-19 US disclosed