SCHEMBL9489197

SCHEMBL9489197

O=C(O)C1(OCCCCCCCCCCCCO)C=CC(c2ccccc2)C=C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.33
PPARG P37231 3/20 0.33
ALDH1A1 P00352 5/20 0.32
CNR2 P34972 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
HPGD P15428 1/20 0.31
SIGMAR1 Q99720 2/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL9490170 1.00 PARP1 (0.33) PARP1PPARGALDH1A1CNR2TDP1
SCHEMBL9462288 0.88 PPARG (0.45) PPARGALDH1A1TDP1MEN1KMT2A
SCHEMBL4186205 0.88 PPARG (0.45) PPARGALDH1A1TDP1MEN1KMT2A
SCHEMBL5828433 0.88 PPARG (0.45) PPARGALDH1A1TDP1MEN1KMT2A
SCHEMBL11363522 0.88 PPARG (0.45) PPARGALDH1A1TDP1MEN1KMT2A
SCHEMBL4184936 0.88 PPARG (0.45) PPARGALDH1A1TDP1MEN1KMT2A
SCHEMBL9487207 0.83 TSHR (0.44) PPARGALDH1A1TDP1HPGDSIGMAR1
SCHEMBL9487483 0.83 TSHR (0.44) PPARGALDH1A1TDP1HPGDSIGMAR1
SCHEMBL10442431 0.83 MAPT (0.43) ALDH1A1TDP1SIGMAR1KMT2A
SCHEMBL6685618 0.81 DUT (0.33) PPARG

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
EP-0228703-B1 FERROELECTRIC LIQUID CRYSTAL POLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-03-10 EP disclosed