SCHEMBL21042591

SCHEMBL21042591

O=C(NC1CCOCC1)c1cn(Cc2ccc(F)cc2)c2c(Cl)ccnc12

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 8/20 0.49
▸ CHRM1 P11229 2/20 0.47
▸ CNR1 P21554 6/20 0.46
▸ CNR2 P34972 6/20 0.46
▸ P2RX7 Q99572 1/20 0.46

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
SCHEMBL16593355 0.87 CHRM1 (0.63) CHRM1
SCHEMBL16593193 0.87 CHRM1 (0.63) CHRM1
SCHEMBL16593210 0.84 CHRM1 (0.62) P2RX3CHRM1
SCHEMBL21042773 0.82 CHRM1 (0.61) CHRM1
SCHEMBL16593317 0.82 CHRM1 (0.61) CHRM1
SCHEMBL19997556 0.78 RPS6KB1 (0.42) —
SCHEMBL16593189 0.78 CHRM1 (0.57) CHRM1
SCHEMBL16593190 0.78 CHRM1 (0.57) CHRM1
SCHEMBL16593192 0.78 CHRM1 (0.57) CHRM1
SCHEMBL21042600 0.77 CHRM1 (0.76) 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-A1 4-AZAINDOLE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2019-05-29 — — EP disclosed
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