SCHEMBL17697639

SCHEMBL17697639

Cc1cccc(-c2ccccc2CO)c1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 3/20 0.58
▸ CD274 Q9NZQ7 3/20 0.58
▸ P2RX7 Q99572 1/20 0.44
▸ TP53 P04637 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ BAZ2B Q9UIF8 2/20 0.41
▸ BAZ2A Q9UIF9 2/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ BRD9 Q9H8M2 1/20 0.41
▸ TRPA1 O75762 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ KCNN4 O15554 1/20 0.38
▸ APOBEC3G Q9HC16 1/20 0.38
▸ PDK2 Q15119 1/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.36

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
SCHEMBL6029512 0.90 PDCD1 (0.66) PDCD1CD274P2RX7TP53GAA
SCHEMBL27481617 0.86 PDCD1 (0.52) PDCD1CD274BAZ2BBAZ2ABRD4
SCHEMBL3858794 0.85 PDCD1 (0.53) PDCD1CD274BAZ2BBAZ2ABRD4
SCHEMBL17697637 0.85 PDCD1 (0.50) PDCD1CD274P2RX7TP53GAA
SCHEMBL30255315 0.84 PDCD1 (0.69) PDCD1CD274P2RX7TP53GAA
SCHEMBL6027619 0.84 PDCD1 (0.69) PDCD1CD274P2RX7TP53GAA
SCHEMBL8537937 0.82 P2RX7 (0.45) PDCD1CD274P2RX7TP53GAA
SCHEMBL16245269 0.81 PDCD1 (0.76) PDCD1CD274BAZ2BBAZ2ABRD4
SCHEMBL92946 0.81 PDCD1 (0.57) PDCD1CD274TP53GAAMAPT
SCHEMBL29645271 0.81 PDCD1 (0.57) PDCD1CD274TP53GAAMAPT

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-3012275-A1 AROMATIC HYDROCARBON FORMALDEHYDE RESIN, MODIFIED AROMATIC HYDROCARBON FORMALDEHYDE RESIN, AND EPOXY RESIN, AND METHOD FOR PRODUCING SAID RESINS Mitsubishi Gas Chemical Company, Inc. (JP) 2016-04-27 — — EP disclosed
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