SCHEMBL9216868

SCHEMBL9216868

CN(CCN1CCNC1=C(C#N)C#N)c1ccco1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
RET P07949 1/20 0.30
KDR P35968 1/20 0.30

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
SCHEMBL9219614 0.80 ACHE (0.30) HRH3
SCHEMBL9218010 0.76 HRH3 (0.34) HRH3
SCHEMBL9852487 0.76 HRH3 (0.34) HRH3
SCHEMBL9217109 0.75 L3MBTL1 (0.35) HRH3
SCHEMBL9213764 0.75 HTT (0.36) MAPTHRH3
SCHEMBL9212791 0.74 PRKCQ (0.30)
SCHEMBL9207992 0.74 HRH3 (0.31) HRH3
SCHEMBL9217079 0.74 HRH3 (0.33) HRH3
SCHEMBL9217518 0.72
SCHEMBL9276596 0.71 ALDH1A1 (0.34) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413343-B1 Furan derivatives KYOWA HAKKO KOGYO KK (JP) 1995-08-02 EP disclosed
US-5075301-A FURAN DERIVATIVES USEFUL FOR THE TREATMENT OF GASTRO-INTESTINAL DISORDERS KYOWA HAKKO KOGYO, CO., LTD. (JP) 1991-12-24 US disclosed
EP-0413343-A2 Furan derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-02-20 EP disclosed