SCHEMBL9431981

SCHEMBL9431981

[CH2]CCCCc1cccc(F)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.57
SLC6A3 Q01959 2/20 0.53
DRD2 P14416 1/20 0.53
SLC6A4 P31645 1/20 0.53
IDO1 P14902 2/20 0.50
AGXT P21549 2/20 0.50
NAAA Q02083 1/20 0.43
DAO P14920 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
SCHEMBL1046626 0.98 TAAR1 (0.55) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL900638 0.94 TAAR1 (0.59) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL1044897 0.85 TAAR1 (0.63) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL6002759 0.83 TAAR1 (0.47) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL15061376 0.81 MAOB (0.68)
SCHEMBL2094562 0.80 TAAR1 (0.49) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL3371633 0.80 TAAR1 (0.74) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL1043920 0.80 TAAR1 (0.57) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL1043921 0.80 TAAR1 (0.57) TAAR1SLC6A3DRD2SLC6A4IDO1
SCHEMBL12693653 0.80 LPL (0.61) TAAR1SLC6A3DRD2SLC6A4

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
US-5347050-A Cardioselective adrenoreceptor blocking agents; prophylaxis and therapy for coronary diseases, glaucoma, migraine BERTHOLD RICHARD (CH) 1994-09-13 US disclosed
EP-0035228-B1 TETRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND ANTI-ULCER COMPOSITION CONTAINING THE SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-01-02 EP disclosed
US-4425362-A CARDIOVASCULAR DISORDERS, ADRENERGIC BLOCKING AGENTS SANDOZ LTD. (CH) 1984-01-10 US disclosed
US-4372953-A Tetrazole derivatives, and anti-ulcer composition containing the same OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1983-02-08 US disclosed
EP-0035228-A1 Tetrazole derivatives, process for the preparation thereof, and anti-ulcer composition containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1981-09-09 EP disclosed
US-4122282-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-10-24 US disclosed
US-4099014-A BLOOD PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1978-07-04 US disclosed
US-4085139-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-04-18 US disclosed
US-4081478-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-03-28 US disclosed
US-4073808-A PROSTAGLANDINS THE UPJOHN COMPANY (US) 1978-02-14 US disclosed
US-4033989-A 9-Deoxy-PGF2 Analogs THE UPJOHN COMPANY (US) 1977-07-05 US disclosed
US-4016184-A PROSTAGLANDINS, BLOOD PLATELET AGGREGATION INHIBITORS THE UPJOHN COMPANY (US) 1977-04-05 US disclosed