SCHEMBL5790792

SCHEMBL5790792

Cc1ccccc1-c1nc2ccc(OC(F)(F)F)cc2c(=O)o1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
C1R P00736 7/20 0.57
PKM P14618 1/20 0.56
NPC1 O15118 1/20 0.48
MAPT P10636 1/20 0.48
F2 P00734 1/20 0.46
ELANE P08246 2/20 0.46
F7 P08709 1/20 0.46
F3 P13726 1/20 0.46
CD74 P04233 1/20 0.44
MIF P14174 1/20 0.44
CTSG P08311 1/20 0.44
KLK7 P49862 1/20 0.44
KLK14 Q9P0G3 1/20 0.44
KLK5 Q9Y337 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL5792385 0.81 PKM (0.83) MEN1KMT2AC1RPKMNPC1
SCHEMBL914103 0.80 C1R (0.65) MEN1KMT2AC1RNPC1ELANE
SCHEMBL5793015 0.78 KMT2A (0.63) MEN1KMT2AC1RPKMNPC1
SCHEMBL17554028 0.78 C1R (0.62) MEN1KMT2AC1RNPC1MAPT
SCHEMBL5371767 0.77 C1R (0.69) MEN1KMT2AC1RNPC1MAPT
SCHEMBL913682 0.77 C1R (0.68) MEN1KMT2AC1RPKMNPC1
SCHEMBL914361 0.75 C1R (0.74) MEN1KMT2AC1RNPC1MAPT
SCHEMBL22272031 0.74 MEN1 (1.00) MEN1KMT2AC1RPKMMAPT
SCHEMBL914778 0.74 APEX1 (0.63) MEN1KMT2AC1RPKMNPC1
SCHEMBL5793545 0.73 C1R (0.76) MEN1KMT2AC1RNPC1MAPT

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
WO-2006012577-A2 QUINAZOLINONE DERIVATIVES USEFUL FOR THE REGULATION OF GLUCOSE HOMEOSTASIS AND FOOD INTAKE BAYER PHARMACEUTICALS CORPORATION (US) 2006-02-02 WO disclosed