SCHEMBL7301800

SCHEMBL7301800

Cc1ccn2ncc(C(=O)NC3CN4CCC3CC4)c2c1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.53
NTRK1 P04629 1/20 0.53
EPHB3 P54753 1/20 0.52
CHRNA7 P36544 1/20 0.48

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
SCHEMBL7300781 0.83 CHRNA7 (0.52) JAK2NTRK1EPHB3CHRNA7
SCHEMBL7298701 0.83 KDM4E (0.54) CHRNA7
Hydrochloric Acid SCHEMBL7302181 0.82 KDM4E (0.53)
SCHEMBL7300863 0.79 CHRNA7 (0.56) CHRNA7
SCHEMBL7309664 0.79 CHRNA7 (0.56) CHRNA7
SCHEMBL7300856 0.79 CHRNA7 (0.56) CHRNA7
SCHEMBL30117426 0.76 NTRK1 (0.45) JAK2NTRK1CHRNA7
SCHEMBL30117391 0.76 NTRK1 (0.45) JAK2NTRK1CHRNA7
SCHEMBL15639178 0.76 NTRK1 (0.45) JAK2NTRK1CHRNA7
SCHEMBL15638989 0.76 NTRK1 (0.45) JAK2NTRK1CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5200415-A Serotonin receptor antagonists; antiemetics, antianxietics ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1993-04-06 US claimed
EP-0483836-A1 Pyrazolo [1,5-a] pyridine-3-carboxylic acid derivatives, their preparation process and their use ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1992-05-06 EP claimed
US-5200415-A Serotonin receptor antagonists; antiemetics, antianxietics ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1993-04-06 US disclosed
EP-0483836-A1 Pyrazolo [1,5-a] pyridine-3-carboxylic acid derivatives, their preparation process and their use ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1992-05-06 EP disclosed