SCHEMBL30281182

SCHEMBL30281182

CCn1nc(C)c(C2CCC(F)(F)CC2)c1C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TEAD1 P28347 1/20 0.34
▸ TEAD4 Q15561 1/20 0.34
▸ TEAD2 Q15562 1/20 0.34
▸ CCNC P24863 1/20 0.33
▸ CDK8 P49336 1/20 0.33
▸ HASPIN Q8TF76 1/20 0.33
▸ OPRM1 P35372 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PARP1 P09874 1/20 0.31
▸ PARP2 Q9UGN5 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
SCHEMBL28974169 0.83 KDM1A (0.36) TEAD1TEAD4TEAD2CDK8OPRM1
SCHEMBL28974193 0.81 RET (0.33) TEAD1TEAD4TEAD2OPRM1PARP1
SCHEMBL28976439 0.80 PARP1 (0.31) TEAD1TEAD4TEAD2OPRM1PARP1
SCHEMBL28976913 0.80 PARP1 (0.31) TEAD1TEAD4TEAD2OPRM1PARP1
SCHEMBL28976466 0.72 PARP1 (0.33) OPRM1PARP1PARP2
SCHEMBL28976914 0.72 KDM1A (0.31) PARP1PARP2
SCHEMBL24758185 0.72 CRHR1 (0.33) —
SCHEMBL28976316 0.71 NPC1 (0.35) TEAD1TEAD4TEAD2OPRM1
SCHEMBL22312633 0.70 KDM4E (0.35) LMNASMN1; SMN2
SCHEMBL28974185 0.69 KDM1A (0.32) —

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-4143195-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2023-03-08 — — EP disclosed
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