SCHEMBL29252887

SCHEMBL29252887

Cn1nc(C(N)=O)c(C2CCC(F)(F)CC2)n1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.34
▸ PARP1 P09874 3/20 0.34
▸ PARP2 Q9UGN5 2/20 0.34
▸ CHRNA7 P36544 2/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ OPRM1 P35372 1/20 0.31
▸ TEAD1 P28347 1/20 0.31
▸ TEAD4 Q15561 1/20 0.31
▸ TEAD2 Q15562 1/20 0.31
▸ CFD P00746 1/20 0.31

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
SCHEMBL28976609 0.87 TEAD1 (0.36) KDM1ACHRNA7EPHX2TEAD1TEAD4
SCHEMBL30281179 0.85 — —
SCHEMBL28976633 0.73 DGAT1 (0.38) PARP1PARP2
SCHEMBL28976697 0.73 SCN10A (0.37) KDM1APARP1PARP2CHRNA7
SCHEMBL30281265 0.72 JAK2 (0.35) KDM1APARP1PARP2OPRM1
SCHEMBL30281156 0.71 — —
SCHEMBL28976577 0.70 SCN10A (0.33) OPRM1
SCHEMBL28976940 0.70 PARP1 (0.32) PARP1PARP2
SCHEMBL28974169 0.69 KDM1A (0.36) KDM1APARP1PARP2OPRM1TEAD1
SCHEMBL15566755 0.65 PARP1 (0.32) PARP1PARP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118317962-A Imidazopyridazine IL-17 inhibitor compounds 詹森药业有限公司 2024-07-09 — — CN disclosed
EP-4143195-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2023-03-08 — — EP disclosed
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