SCHEMBL28856142

SCHEMBL28856142

CCC(C(=O)Oc1ccccc1)=C(c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.50
PTGS2 P35354 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
ESR1 P03372 2/20 0.40
CYP19A1 P11511 1/20 0.40
ALDH1A1 P00352 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL20163295 0.82 ELANE (0.45) ELANEALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29117671 0.82 ELANE (0.45) ELANECES2CES1CYP19A1ALDH1A1
SCHEMBL28234691 0.82 ELANE (0.42) ELANEPTGS2ESR1ALDH1A1MAPT
SCHEMBL29117710 0.81 CYP19A1 (0.45) ELANECES2CES1CYP19A1ALDH1A1
SCHEMBL10615120 0.77 CES1 (0.52) PTGS2CES2CES1ESR1CYP19A1
SCHEMBL6475627 0.77 CES2 (0.44) ELANECES2CES1ESR1CYP19A1
SCHEMBL461096 0.77 ELANE (0.53) ELANECES2CES1ESR1ALDH1A1
SCHEMBL1145280 0.76 ELANE (0.50) ELANEPTGS2CES2CES1ESR1
SCHEMBL6204941 0.76 ELANE (0.50) ELANEPTGS2CES2CES1ESR1
SCHEMBL28144760 0.76 ELANE (0.42) ELANECYP19A1ALDH1A1NPC1RAB9A

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-115141304-A High-refraction film-forming resin containing triphenylmethanol ester structure and photoresist composition 江苏集萃光敏电子材料研究所有限公司 2022-10-04 CN disclosed