SCHEMBL8918312

SCHEMBL8918312

C=C(C)C(=O)OOOc1ccc(C(C)(C)c2ccc(OOOC(=O)C(=C)C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.36
KDM4E B2RXH2 7/20 0.35
POLB P06746 3/20 0.35
AR P10275 2/20 0.34
ESR1 P03372 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
HTR6 P50406 1/20 0.34
ESRRG P62508 1/20 0.34
SLC6A3 Q01959 1/20 0.34
ESR2 Q92731 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 6/20 0.34
KMT2A Q03164 3/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 2/20 0.34

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
SCHEMBL16259055 0.80 ELANE (0.47) ELANEKDM4EPOLBHPGDMAPT
SCHEMBL30971 0.80 ELANE (0.56) ELANEKDM4EPOLBARESR1
SCHEMBL14173071 0.80 ELANE (0.56) ELANEKDM4EPOLBARESR1
SCHEMBL8585795 0.75 ELANE (0.51) ELANEKDM4EPOLBARESR1
SCHEMBL25926581 0.75 ELANE (0.51) ELANEKDM4EPOLBARESR1
Methacrylic Acid SCHEMBL8101356 0.75 ELANE (0.55) ELANEKDM4EPOLBMAPTALDH1A1
SCHEMBL3899570 0.75 ELANE (0.51) ELANEKDM4EPOLBARESR1
SCHEMBL1123797 0.75 ELANE (0.44) ELANEKDM4EPOLBARMAPT
SCHEMBL51951 0.74 ESR1 (0.52) ELANEKDM4EARESR1CYP3A4
SCHEMBL36873 0.74 ELANE (0.62) ELANEKDM4EPOLBESR1CYP3A4

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-5667930-A Photoresist composition containing 4,6-(bis)chloromethyl-5-triazine initiator CHEIL SYNTHETICS INCORPORATION (KR) 1997-09-16 US disclosed