SCHEMBL14181567

SCHEMBL14181567

CC1(C)N/C(=C\C(=O)c2ccncc2)c2ccccc2O1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PSMD14 O00487 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TGM2 P21980 2/20 0.36
RAB9A P51151 2/20 0.35
NPC1 O15118 2/20 0.35
HTT P42858 2/20 0.35
CYP1A2 P05177 3/20 0.34
CYP2D6 P10635 2/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
CYP2C19 P33261 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL4843983 0.90 RAB9A (0.41) MAPTRAB9ANPC1HTTCYP1A2
SCHEMBL4846988 0.82 MAPT (0.38) MAPTL3MBTL1RAB9AALDH1A1GLA
SCHEMBL4845901 0.78 ABCG2 (0.42) TGM2ALDH1A1HPGDTSHRMAPK1
SCHEMBL4842742 0.77 RAB9A (0.38) MAPTTGM2RAB9ANPC1CYP1A2
SCHEMBL4843746 0.77 RAB9A (0.38) MAPTMEN1KMT2ATGM2RAB9A
SCHEMBL14181546 0.76 TGM2 (0.37) MAPTMEN1KMT2APSMD14L3MBTL1
SCHEMBL4841022 0.76 CDYL2 (0.38) MAPTTGM2RAB9ANPC1HTT
SCHEMBL4841185 0.76 TGM2 (0.37) MAPTTGM2RAB9ANPC1HTT
SCHEMBL14181753 0.76 RAB9A (0.36) MAPTTGM2RAB9ANPC1CYP1A2
SCHEMBL4844537 0.76 PGR (0.38) MAPTRAB9ANPC1CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7378428-B2 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-27 US disclosed