SCHEMBL19393423

SCHEMBL19393423

C=Cc1cccc(Cn2c3c(c(=O)c4ccccc42)C=CCC3)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 2/20 0.40
▸ FAAH O00519 1/20 0.38
▸ NTRK1 P04629 1/20 0.36
▸ HDAC6 Q9UBN7 2/20 0.36
▸ MAPT P10636 1/20 0.35
▸ PSMD14 O00487 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35

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
SCHEMBL1224850 0.81 P2RX4 (0.62) P2RX4FAAHNTRK1MAPTPSMD14
SCHEMBL12319406 0.75 CYP19A1 (0.58) P2RX4FAAHMAPTPSMD14LMNA
SCHEMBL15149266 0.75 ALDH1A1 (0.55) P2RX4LMNA
SCHEMBL103368 0.73 ABCB1 (0.40) P2RX4MAPTLMNA
SCHEMBL18500036 0.72 P2RX4 (0.49) P2RX4NTRK1MAPTPSMD14LMNA
SCHEMBL18713337 0.72 GLA (0.58) —
SCHEMBL21765759 0.71 CA1 (0.52) P2RX4HDAC6HDAC2HDAC8CA1
SCHEMBL10064600 0.69 PSMD14 (0.40) P2RX4HDAC6MAPTPSMD14LMNA
SCHEMBL23240722 0.67 PSMD14 (0.35) P2RX4FAAHHDAC6MAPTPSMD14
SCHEMBL1223439 0.66 P2RX4 (0.68) P2RX4NTRK1HDAC6MAPTPSMD14

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-2295505-B1 Ink composition, ink set and image forming method FUJIFILM CORP (JP) 2017-09-27 — — EP disclosed
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