SCHEMBL30337066

SCHEMBL30337066

O=C1C2CN(Cc3cnc4ccccc4c3)CCN2C(=O)CN1Cc1cccnc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 13/20 0.48
▸ CXCR4 P61073 1/20 0.47
▸ DPP4 P27487 1/20 0.41
▸ DPP8 Q6V1X1 1/20 0.41
▸ DOCK5 Q9H7D0 1/20 0.40
▸ HCRTR2 O43614 1/20 0.39

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
SCHEMBL30337148 0.92 FAAH (0.46) FAAHDPP4DPP8DOCK5
SCHEMBL30337129 0.88 KMT2A (0.46) —
SCHEMBL28980919 0.88 KMT2A (0.46) —
SCHEMBL30337153 0.86 FAAH (0.48) FAAHDPP4DPP8
SCHEMBL30337587 0.85 FAAH (0.44) FAAHDPP4DPP8
SCHEMBL30337505 0.82 ALDH1A1 (0.46) —
SCHEMBL30337111 0.79 FAAH (0.43) FAAHDPP4DPP8DOCK5
SCHEMBL26093721 0.79 FAAH (0.43) FAAHDPP4DPP8DOCK5
SCHEMBL30337323 0.78 HTR1A (0.45) FAAHDPP4DPP8HCRTR2
SCHEMBL28980917 0.77 FAAH (0.48) FAAHDPP4DPP8DOCK5

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
CN-115916206-A Novel compound and pharmaceutical composition for preventing or treating resistant cancer comprising same 治愈医药社株式会社 2023-04-04 — — CN disclosed
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