SCHEMBL31559989

SCHEMBL31559989

O=C(O)C1(F)C=CC(c2ccc(O)cc2)=CC1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP3A4 P08684 1/20 0.33
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MMP3 P08254 1/20 0.31
BCL2L1 Q07817 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
HSD17B10 Q99714 1/20 0.30
HSD17B1 P14061 1/20 0.30

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
SCHEMBL3947332 0.87 THRB (0.31)
SCHEMBL6135814 0.78 HSD17B1 (0.33) APPCYP2C19CYP2D6CYP2C9CYP3A4
SCHEMBL28789047 0.73 XDH (0.41)
SCHEMBL3883554 0.70 ALDH1A1 (0.33) MEN1MAPTRAB9AKMT2AALDH1A1
SCHEMBL6135426 0.69 GRIN2B (0.35) MEN1MAPTRAB9AKMT2AALDH1A1
SCHEMBL1862794 0.69 MMP3 (0.38) CYP2D6MEN1LMNAMAPTRAB9A
SCHEMBL9486983 0.68 MMP3 (0.41) MEN1LMNAMAPTRAB9AKMT2A
4-Hydroxybenzaldehyde SCHEMBL29147329 0.67 ALDH5A1 (0.43) CYP3A4MEN1LMNAMAPTRAB9A
SCHEMBL316146 0.67 THRB (0.32)
SCHEMBL4450466 0.67 MMP3 (0.44) MEN1LMNAMAPTRAB9AKMT2A

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-119786879-A Lithium ion battery diaphragm modified by high-temperature fluorine-containing liquid crystal polymer and polyvinylidene fluoride, and preparation method and application thereof 江苏超电新能源科技发展有限公司 2025-04-08 CN disclosed