SCHEMBL17697641

SCHEMBL17697641

Cc1ccccc1-c1cccc(CO)c1CO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 3/20 0.52
CD274 Q9NZQ7 3/20 0.52
MAPT P10636 2/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
APOBEC3G Q9HC16 1/20 0.36
BRD4 O60885 1/20 0.36
PDK2 Q15119 1/20 0.36
DPP4 P27487 2/20 0.35
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 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
SCHEMBL29037324 0.87 PDCD1 (0.47) PDCD1CD274MAPTPDK2DPP4
SCHEMBL17697637 0.87 PDCD1 (0.50) PDCD1CD274MAPTTP53GAA
SCHEMBL1589599 0.84 DPP4 (0.41) PDCD1CD274GAABRD4DPP4
SCHEMBL3858794 0.84 PDCD1 (0.53) PDCD1CD274APOBEC3GBRD4DPP4
SCHEMBL6027619 0.82 PDCD1 (0.69) PDCD1CD274MAPTTP53GAA
SCHEMBL30255315 0.82 PDCD1 (0.69) PDCD1CD274MAPTTP53GAA
SCHEMBL148754 0.81 PDCD1 (0.45) PDCD1CD274HSD17B10APOBEC3GTAAR1
SCHEMBL8497184 0.81 PDCD1 (0.52) PDCD1CD274MAPTTP53GAA
SCHEMBL31396711 0.79 PDCD1 (0.50) PDCD1CD274APOBEC3GBRD4PDK2
SCHEMBL31396741 0.79 PDCD1 (0.50) PDCD1CD274MAPTGAAAPOBEC3G

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9562130-B2 Aromatic hydrocarbon formaldehyde resin, modified aromatic hydrocarbon formaldehyde resin and epoxy resin, and methods for producing these MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-02-07 US disclosed
US-20160130384-A1 AROMATIC HYDROCARBON FORMALDEHYDE RESIN, MODIFIED AROMATIC HYDROCARBON FORMALDEHYDE RESIN AND EPOXY RESIN, AND METHODS FOR PRODUCING THESE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-05-12 US disclosed
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