SCHEMBL22001758

SCHEMBL22001758

Cc1ccnc2c(C(=O)N[C@H]3CCCCC3O)cn(Cc3ccc(OC(F)(F)F)cc3)c12

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 19/20 0.60
▸ CNR1 P21554 1/20 0.44

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
SCHEMBL16593267 1.00 CHRM1 (0.60) CHRM1CNR1
SCHEMBL22001288 0.91 CHRM1 (0.59) CHRM1CNR1
SCHEMBL16593263 0.91 CHRM1 (0.59) CHRM1CNR1
SCHEMBL16593424 0.90 CHRM1 (0.74) CHRM1
SCHEMBL16593207 0.88 CHRM1 (0.59) CHRM1
SCHEMBL16593186 0.88 CHRM1 (0.61) CHRM1
SCHEMBL16593321 0.87 CHRM1 (0.60) CHRM1
SCHEMBL16593359 0.85 CHRM1 (0.80) CHRM1
SCHEMBL16593196 0.84 CHRM1 (0.57) CHRM1
SCHEMBL22001290 0.84 CHRM1 (0.59) CHRM1

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-3489237-B1 4-AZAINDOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2020-05-13 — — EP disclosed
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