SCHEMBL28016471

SCHEMBL28016471

CCOP(=O)(OCC)OCOC(=O)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
BTN3A1 O00481 6/20 0.45
ALDH1A1 P00352 1/20 0.44
ENO1 P06733 1/20 0.43
PRKCA P17252 1/20 0.34
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
PPARD Q03181 1/20 0.32
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL10378800 0.92 BTN3A1 (0.50) TSHRBTN3A1ALDH1A1ENO1PRKCA
SCHEMBL21246003 0.83 BTN3A1 (0.44) BTN3A1ALDH1A1ENO1PRKCAFNTA
SCHEMBL13141363 0.82 BTN3A1 (0.46) BTN3A1ALDH1A1ENO1PRKCAFNTA
SCHEMBL9891073 0.78 BTN3A1 (0.54) TSHRBTN3A1ALDH1A1ENO1PRKCA
SCHEMBL28720185 0.78 BTN3A1 (0.53) BTN3A1ALDH1A1ENO1PRKCAFNTA
SCHEMBL18413007 0.78 TSHR (0.56) TSHRALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL3437081 0.78 BTN3A1 (0.53) BTN3A1ALDH1A1ENO1PRKCAFNTA
SCHEMBL9891063 0.78 BTN3A1 (0.49) BTN3A1ALDH1A1ENO1PRKCAFNTA
SCHEMBL10378801 0.78 BTN3A1 (0.49) BTN3A1ALDH1A1ENO1PRKCAFNTA
SCHEMBL2458617 0.76 BTN3A1 (0.60) BTN3A1ALDH1A1ENO1PRKCAFNTA

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
CN-102854749-B Photosensitive resin composition for color filter and color filter using same CHEIL IND INC 2015-05-27 CN disclosed