SCHEMBL4947676

SCHEMBL4947676

NC(=O)c1n[c]cn1CCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 3/20 0.43
KDR P35968 3/20 0.43
MAOB P27338 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NR3C2 P08235 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
IDO1 P14902 2/20 0.38
DAO P14920 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HMOX1 P09601 1/20 0.36
KMT2A Q03164 1/20 0.35
FFAR1 O14842 1/20 0.35

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
SCHEMBL2980377 0.69 CES2 (0.38) KMT2A
SCHEMBL5713331 0.67 ALDH1A1 (0.55) FLT1KDRMAOBKDM4EALDH1A1
SCHEMBL2316007 0.66 TAAR1 (0.57) MAOBNR3C2TAAR1IDO1HDAC1
SCHEMBL5983327 0.65 KDM4E (0.41) KDM4EALDH1A1SMN1; SMN2TAAR1
SCHEMBL934147 0.65 HDAC1 (0.57) MAOBNR3C2TAAR1IDO1HDAC1
SCHEMBL22190365 0.64 TAAR1 (0.50) MAOBNR3C2TAAR1IDO1HDAC1
SCHEMBL14973107 0.64 KDM4E (0.43) FLT1KDRMAOBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL28626980 0.64 SIRT2 (0.44) MAOBSMN1; SMN2TAAR1IDO1DAO
SCHEMBL25138775 0.64 HDAC1 (0.59) MAOBNR3C2TAAR1IDO1HDAC1
Hydrochloric Acid SCHEMBL30882461 0.64 HDAC1 (0.55) MAOBNR3C2TAAR1IDO1HDAC1

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
EP-1940802-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Pfizer Products Inc. (US) 2008-07-09 EP disclosed
WO-2007034326-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PFIZER PRODUCTS INC. (US) 2007-03-29 WO disclosed