SCHEMBL31282708

SCHEMBL31282708

Cn1c(=O)n(C2CCCNC2)c2ccc(CN3CCC(C4CCNCC4)CC3)cc21

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 2/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ GNAI3 P08754 1/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ DDB1 Q16531 2/20 0.37
▸ CRBN Q96SW2 2/20 0.37
▸ CTSS P25774 5/20 0.37
▸ OPRL1 P41146 1/20 0.35
▸ DRD4 P21917 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ CXCR4 P61073 2/20 0.34
▸ OPRM1 P35372 3/20 0.34
▸ GNRHR P30968 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
SCHEMBL31281909 0.90 DRD2 (0.41) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL31282427 0.90 DRD2 (0.41) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL31282370 0.90 DRD2 (0.40) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL31281965 0.89 DRD2 (0.39) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL31282081 0.89 DRD2 (0.44) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL31281914 0.86 DRD2 (0.38) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL31282093 0.86 DRD2 (0.38) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL31282557 0.84 DRD2 (0.36) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL30798793 0.83 DRD2 (0.39) DRD2SLC6A4CYP3A4DDB1CRBN
SCHEMBL30733897 0.83 DDB1 (0.40) DRD2SLC6A4DDB1CRBNGNRHR

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
EP-4731309-A1 KRAS PROTEOLYSIS TARGETING CHIMERAS Paq Therapeutics Inc. (US) 2026-04-29 — — EP disclosed
WO-2024263586-A1 KRAS PROTEOLYSIS TARGETING CHIMERAS PAQ Therapeutics Inc. (US) 2024-12-26 — — WO disclosed
Send feedback