SCHEMBL25633371

SCHEMBL25633371

CC(I)N1CCn2nccc2C1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 3/20 0.34
▸ DRD4 P21917 3/20 0.34
▸ DRD3 P35462 3/20 0.34
▸ SOS1 Q07889 1/20 0.32

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
SCHEMBL10360901 0.86 DRD2 (0.36) DRD2DRD4DRD3SOS1
SCHEMBL22867309 0.80 DRD2 (0.33) DRD2DRD4DRD3SOS1
SCHEMBL12826444 0.80 DRD2 (0.38) DRD2DRD4DRD3SOS1
SCHEMBL20682229 0.77 KDM4E (0.33) DRD2DRD4DRD3SOS1
SCHEMBL14934068 0.76 DRD2 (0.36) DRD2DRD4DRD3
SCHEMBL25784871 0.76 DRD2 (0.34) DRD2DRD4DRD3
SCHEMBL25791832 0.73 DRD2 (0.33) DRD2DRD4DRD3
SCHEMBL19163915 0.73 DRD2 (0.30) DRD2DRD4DRD3
SCHEMBL25682197 0.72 DRD2 (0.35) DRD2DRD4DRD3
SCHEMBL26311187 0.71 KCNA5 (0.32) DRD2DRD4DRD3

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-2023098825-A1 SOS1 INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 勤浩医药(苏州)有限公司 2023-06-08 — — WO disclosed
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