SCHEMBL19375035

SCHEMBL19375035

CN1c2nc(CCCO)n(Cc3ccc(Cl)cc3)c2C(=O)N(CCCOC2CCCCO2)C1O

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 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
SCHEMBL21499666 0.93 P2RX3 (0.43) P2RX3
SCHEMBL20432337 0.88 P2RX3 (0.46) P2RX3
SCHEMBL19375462 0.88 P2RX3 (0.46) P2RX3
SCHEMBL18834374 0.84 P2RX3 (0.38) P2RX3
SCHEMBL20656224 0.83 P2RX3 (0.46) P2RX3
SCHEMBL21316331 0.83 P2RX3 (0.45) P2RX3
SCHEMBL19375479 0.83 P2RX3 (0.43) P2RX3
SCHEMBL21499689 0.79 PDE5A (0.41) P2RX3
SCHEMBL21316333 0.78 P2RX3 (0.40) P2RX3
SCHEMBL19505466 0.78 P2RX3 (0.39) P2RX3

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-2970303-B3 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2018-08-01 — — EP disclosed
EP-2970303-B9 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2017-09-20 — — EP disclosed
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