SCHEMBL25721981

SCHEMBL25721981

COC(=O)c1ccc(Cc2ccc(C(=O)OC)cc2C)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.52
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
CA12 O43570 2/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52
CA14 Q9ULX7 2/20 0.52
XDH P47989 1/20 0.52
ALDH1A1 P00352 4/20 0.50
MAPT P10636 6/20 0.49
GAA P10253 2/20 0.49
LMNA P02545 2/20 0.49
GPR84 Q9NQS5 1/20 0.48
KDM4E B2RXH2 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
GLA P06280 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
ATM Q13315 1/20 0.47

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
SCHEMBL14175211 0.89 TDP1 (0.52) TDP1CA1CA2CA12CA7
SCHEMBL2968528 0.87 ALDH1A1 (0.53) TDP1CA1CA2CA12CA7
SCHEMBL9479617 0.86 CA1 (0.49) TDP1CA1CA2CA12CA7
SCHEMBL20798434 0.86 CA1 (0.49) TDP1CA1CA2CA12CA7
SCHEMBL16258615 0.86 CA1 (0.49) TDP1CA1CA2CA12CA7
SCHEMBL1495874 0.86 LOXL2 (0.56) TDP1CA1CA2CA12CA7
SCHEMBL7718888 0.86 CA1 (0.49) TDP1CA1CA2CA12CA7
SCHEMBL19647679 0.84 CA1 (0.47) TDP1CA1CA2CA12CA7
SCHEMBL13553385 0.84 PPARG (0.51) TDP1CA1CA2CA12CA7
Hydrochloric Acid SCHEMBL988295 0.84 LOXL2 (0.54) TDP1CA1CA2CA12CA7

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
US-11676814-B2 Material for forming organic film, substrate for manufacturing semiconductor apparatus, method for forming organic film, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-06-13 US disclosed