SCHEMBL8478659

SCHEMBL8478659

Cc1ccc(CC2CN(C(=O)/C=C/c3ccc(F)cc3)CCN2C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
TACR1 P25103 4/20 0.41
GPR183 P32249 11/20 0.41
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL9236774 1.00 L3MBTL1 (0.42) L3MBTL1TACR1GPR183ALDH1A1LMNA
SCHEMBL8478660 1.00 L3MBTL1 (0.42) L3MBTL1TACR1GPR183ALDH1A1LMNA
SCHEMBL9236781 1.00 L3MBTL1 (0.42) L3MBTL1TACR1GPR183ALDH1A1LMNA
SCHEMBL9239257 0.95 GPR183 (0.45) TACR1GPR183
SCHEMBL9239267 0.95 GPR183 (0.45) TACR1GPR183
SCHEMBL8477810 0.95 GPR183 (0.45) TACR1GPR183
SCHEMBL9238971 0.93 RHOC (0.44) TACR1GPR183
SCHEMBL8480591 0.93 RHOC (0.44) TACR1GPR183
SCHEMBL9238976 0.93 RHOC (0.44) TACR1GPR183
SCHEMBL8480595 0.93 RHOC (0.44) TACR1GPR183

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883098-A USED AS TACHYKININ ANTAGONISTS IN THE TREATMENT OF RESPIRATORY DISEASES, OPHTHALMIC DISEASES AND INFLAMMATORY DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-03-16 US disclosed
US-5670505-A TACHYKIKIN ANTAGONIST FOR RESPIRATORY DISEASES, OPHTHALMIC DISEASES AND ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-09-23 US disclosed