SCHEMBL9080899

SCHEMBL9080899

Cc1nc2c(NC(=O)c3c(Cl)cccc3Cl)cccn2c1CC#N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 4/20 0.47
ATP4B P51164 4/20 0.47
KMT2A Q03164 5/20 0.46
MEN1 O00255 3/20 0.46
CYP3A4 P08684 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
MAPK1 P28482 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
CRHBP P24387 1/20 0.46
HTT P42858 1/20 0.46
CRHR2 Q13324 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
RAB9A P51151 2/20 0.39

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
SCHEMBL9081462 0.87 KMT2A (0.48) ATP4AATP4BKMT2AMEN1CYP3A4
SCHEMBL9081771 0.86 MEN1 (0.42) ATP4AATP4BKMT2AMEN1CYP3A4
SCHEMBL9080517 0.85 KMT2A (0.49) KMT2AMEN1CYP3A4CYP1A2CYP2C9
SCHEMBL9080622 0.85 KMT2A (0.46) KMT2AMEN1CYP3A4MAPK1CRHBP
SCHEMBL9081500 0.84 KMT2A (0.46) KMT2AMEN1CYP3A4CRHBPHTT
SCHEMBL9231591 0.84 PTGES (0.46) KMT2AMEN1CRHBPHTTCRHR2
SCHEMBL9081354 0.83 KMT2A (0.48) KMT2AMEN1CYP3A4CYP1A2CYP2D6
SCHEMBL9080404 0.83 KMT2A (0.48) KMT2AMEN1CYP3A4CRHBPHTT
SCHEMBL9081886 0.83 KMT2A (0.45) ATP4AATP4BKMT2AMEN1CYP3A4
SCHEMBL9082430 0.83 KMT2A (0.45) KMT2AMEN1CRHBPHTTCRHR2

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-1996034866-A1 IMIDAZO 1,2-A PYRIDINE AND IMIDAZO 1,2-A PYRIDEZINE DERIVATIVES AND THEIR USE AS BONE RESORPTION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-07 WO disclosed