SCHEMBL23889347

SCHEMBL23889347

Cc1nc(I)c2cnccc2n1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.37
NPY5R Q15761 1/20 0.33
ATM Q13315 1/20 0.33
TNF P01375 1/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
ACHE P22303 1/20 0.33
HASPIN Q8TF76 2/20 0.32
MAPK10 P53779 1/20 0.32
MAOA P21397 2/20 0.32
XPO1 O14980 1/20 0.32
TOP2A P11388 1/20 0.30
CDK2 P24941 1/20 0.30
DYRK1A Q13627 1/20 0.30
DYRK1B Q9Y463 1/20 0.30
EGFR P00533 1/20 0.30
PIM1 P11309 1/20 0.30

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
SCHEMBL22054633 0.82 DHODH (0.40) DHODHNPY5RATMTNFLMNA
SCHEMBL21297878 0.78 DHODH (0.41) DHODHATMTNFLMNAACHE
SCHEMBL31194906 0.77 CLK1 (0.42) DHODHNPY5RLMNAHTTDYRK1A
SCHEMBL24175001 0.77 CLK1 (0.42) DHODHNPY5RLMNAHTTDYRK1A
SCHEMBL12736849 0.74 LATS1 (0.47) DHODHLMNAHTTXPO1EGFR
SCHEMBL24996414 0.74 DHODH (0.35) DHODHNPY5RATMTNFLMNA
SCHEMBL18544725 0.74 LMNA (0.52) LMNAHTTACHEMAPK10MAOA
SCHEMBL27110226 0.72 TNF (0.35) DHODHTNFLMNAHTTACHE
SCHEMBL22956798 0.72 CYP1A2 (0.40) DHODHLMNAACHEHASPINMAPK10
SCHEMBL19004155 0.72 HIPK2 (0.37) DHODHATMTNFHTTACHE

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
EP-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 EP disclosed