SCHEMBL5941266

SCHEMBL5941266

NC1C(=O)CCc2ncccc21

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 2/20 0.42
▸ CYP19A1 P11511 4/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ TBXAS1 P24557 4/20 0.35
▸ TRPM8 Q7Z2W7 1/20 0.34
▸ AKR1C3 P42330 1/20 0.32
▸ MAPK14 Q16539 1/20 0.31

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
SCHEMBL6386269 0.77 HTR2A (0.50) ANPEPCYP19A1CYP2D6
SCHEMBL4238327 0.72 TYMS (0.37) CYP19A1CYP2D6
SCHEMBL31114626 0.72 CYP19A1 (0.43) CYP19A1CYP2D6TBXAS1TRPM8
SCHEMBL14578648 0.72 CYP19A1 (0.43) CYP19A1CYP2D6TBXAS1TRPM8
SCHEMBL1266396 0.72 CYP19A1 (0.43) CYP19A1CYP2D6TBXAS1TRPM8
SCHEMBL31114621 0.72 CYP19A1 (0.43) CYP19A1CYP2D6TBXAS1TRPM8
SCHEMBL14578647 0.72 CYP19A1 (0.43) CYP19A1CYP2D6TBXAS1TRPM8
Hydrochloric Acid SCHEMBL22031926 0.70 CYP19A1 (0.42) CYP19A1CYP2D6TBXAS1TRPM8
Hydrochloric Acid SCHEMBL31365166 0.70 CYP19A1 (0.42) CYP19A1CYP2D6TBXAS1TRPM8
Hydrochloric Acid SCHEMBL26962733 0.70 CYP19A1 (0.42) CYP19A1CYP2D6TBXAS1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060079495-A1 Diagnosis and treatment system for \"reward deficiency syndrome\" (RDS) and related behaviors SYNAPTAMINE, INC. 2006-04-13 — — US disclosed
US-6955873-B1 Diagnosis and treatment system for reward deficiency syndrome (RDS) and related behaviors SYNAPTAMINE, INC. 2005-10-18 — — US disclosed
US-6132724-A Allelic polygene diagnosis of reward deficiency syndrome and treatment CITY OF HOPE NATIONAL MEDICAL CENTER (US) 2000-10-17 — — US disclosed
EP-0979092-A2 ALLELIC POLYGENE DIAGNOSIS OF REWARD DEFICIENCY SYNDROME AND TREATMENT Kenneth Blum, Inc. (US) 2000-02-16 — — EP disclosed
WO-1998048785-A9 ALLELIC POLYGENE DIAGNOSIS OF REWARD DEFICIENCY SYNDROME AND TREATMENT KENNETH BLUM INC (US) 1999-05-20 — — WO disclosed
WO-1998048785-A2 ALLELIC POLYGENE DIAGNOSIS OF REWARD DEFICIENCY SYNDROME AND TREATMENT KENNETH BLUM, INC. (US) 1998-11-05 — — WO disclosed
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