SCHEMBL11808484

SCHEMBL11808484

Cc1cncn1-c1ccc(C(F)(F)F)cc1Cc1ccccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.40
NR2E1 Q9Y466 2/20 0.38
P2RX7 Q99572 2/20 0.37
CSNK1D P48730 1/20 0.36
SMO Q99835 1/20 0.35
MC4R P32245 1/20 0.35
MAPT P10636 1/20 0.35
TP53 P04637 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KCNJ5 P48544 1/20 0.34
KCNJ3 P48549 1/20 0.34
GRIN2B Q13224 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
PDE2A O00408 1/20 0.34
PDE10A Q9Y233 1/20 0.34
GAA P10253 1/20 0.34
ATM Q13315 1/20 0.34
NPY5R Q15761 1/20 0.33

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
SCHEMBL11820800 0.86 HSD11B1 (0.38) HSD11B1P2RX7MAPTTP53MEN1
SCHEMBL11777337 0.85 GPBAR1 (0.37) P2RX7MAPTPTGDR2
SCHEMBL11774993 0.84 PTGDR2 (0.41) SMOPTGDR2NPY5R
SCHEMBL11776643 0.84 ADORA2A (0.38) P2RX7MEN1KMT2AGAA
SCHEMBL11774188 0.83 P2RX7 (0.41) HSD11B1NR2E1P2RX7CSNK1DSMO
SCHEMBL11773018 0.79 CYP1A2 (0.39) MAPTMEN1KMT2A
SCHEMBL11818051 0.76 RORB (0.46) HSD11B1MAPTMEN1KMT2AGAA
SCHEMBL11772878 0.72 P2RX7 (0.36) HSD11B1P2RX7MAPTTP53MEN1
SCHEMBL11775812 0.72 HPGD (0.40) NR2E1MAPTTP53GAA
SCHEMBL11772838 0.72 MEN1 (0.46) MEN1KMT2APTGDR2

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-3941803-A 2-(Imidazol-1-yl)benzophenones THE UPJOHN COMPANY (US) 1976-03-02 US disclosed