SCHEMBL9080202

SCHEMBL9080202

O=C(Nc1cccn2c(CCSc3ncc[nH]3)c(C(F)(F)F)nc12)c1c(Cl)cccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 3/20 0.38
JAK2 O60674 2/20 0.38
JAK1 P23458 2/20 0.38
HDAC1 Q13547 1/20 0.36
MEN1 O00255 1/20 0.36
CRHBP P24387 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
CRHR2 Q13324 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 2/20 0.34
PTGES O14684 2/20 0.33
CDK14 O94921 5/20 0.33
CCNY Q8ND76 5/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
CDK4 P11802 1/20 0.33
CDK2 P24941 1/20 0.33
CDK5 Q00535 1/20 0.33
LMNA P02545 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
Hydrochloric Acid SCHEMBL9082391 0.99 TYK2 (0.38) TYK2JAK2JAK1HDAC1MEN1
Hydrochloric Acid SCHEMBL9080664 0.89 CDK14 (0.35) TYK2JAK2JAK1HDAC1MEN1
SCHEMBL9080749 0.84 TYK2 (0.41) TYK2JAK2JAK1HDAC1MEN1
Hydrochloric Acid SCHEMBL9081568 0.83 TYK2 (0.40) TYK2JAK2JAK1HDAC1MEN1
SCHEMBL9283353 0.81 KMT2A (0.43) TYK2JAK2JAK1MEN1CRHBP
SCHEMBL9080031 0.79 KMT2A (0.45) TYK2JAK2JAK1MEN1CRHBP
SCHEMBL9081108 0.79 KMT2A (0.45) TYK2JAK2JAK1MEN1CRHBP
Hydrochloric Acid SCHEMBL9080397 0.79 HDAC1 (0.39) TYK2JAK2JAK1HDAC1MEN1
Hydrochloric Acid SCHEMBL9080756 0.79 TYK2 (0.44) TYK2JAK2JAK1MEN1CRHBP
SCHEMBL9081543 0.79 MEN1 (0.40) TYK2JAK2JAK1MEN1CRHBP

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