SCHEMBL21609892

SCHEMBL21609892

CCOc1ccc(OC(=O)C2CCC(C3CCCCC3)CC2)c(F)c1F

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.40
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
GLA P06280 1/20 0.39
POLB P06746 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 1/20 0.38
APOBEC3G Q9HC16 1/20 0.37
HTT P42858 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL16769029 0.99 HPGD (0.46) HPGDSMN1; SMN2ESR1ESR2GLA
SCHEMBL16769030 0.96 HPGD (0.46) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL22277282 0.90 HPGD (0.44) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL18012158 0.90 HPGD (0.44) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL9562690 0.88 HPGD (0.43) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL9562686 0.88 HPGD (0.43) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL7910499 0.86 HPGD (0.42) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL7910502 0.86 HPGD (0.42) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL7910505 0.86 HPGD (0.42) HPGDSMN1; SMN2GLAPOLBKMT2A
SCHEMBL20017230 0.85 SCN9A (0.38) HPGDESR1ESR2

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-10519377-B1 Liquid crystal composition of negative monomer containing cyclopentyl cyclohexenyl and liquid crystal display element or liquid crystal display thereof Shijiazhuang Chengzhi Yonghua Display Material Co., Ltd (CN) 2019-12-31 US disclosed