SCHEMBL22025534

SCHEMBL22025534

CCOc1ccc(C2(c3ccc(OCCO)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 10/20 0.48
▸ ALDH1A1 P00352 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ NR1I2 O75469 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ ALOX5AP P20292 1/20 0.40
▸ NQO1 P15559 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40

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
SCHEMBL17050236 0.93 PDK2 (0.54) PDK2ALDH1A1RECQLNR1I2KDM4E
SCHEMBL194556 0.93 PDK2 (0.54) PDK2ALDH1A1RECQLNR1I2KDM4E
SCHEMBL30211372 0.93 PDK2 (0.54) PDK2ALDH1A1RECQLNR1I2KDM4E
SCHEMBL29351148 0.93 PDK2 (0.54) PDK2ALDH1A1RECQLNR1I2KDM4E
SCHEMBL12190067 0.91 PDK2 (0.50) PDK2ALDH1A1RECQLNR1I2KDM4E
SCHEMBL27968424 0.90 PDK2 (0.47) PDK2ALDH1A1RECQLNR1I2KDM4E
SCHEMBL20411195 0.90 ALDH1A1 (0.55) PDK2ALDH1A1RECQLNR1I2KDM4E
SCHEMBL14119981 0.89 SMN1; SMN2 (0.52) PDK2ALDH1A1KDM4EMEN1LMNA
SCHEMBL13729302 0.89 PDK2 (0.48) PDK2ALDH1A1RECQLKDM4EMEN1
SCHEMBL816921 0.88 PDK2 (0.50) PDK2ALDH1A1RECQLNR1I2KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192951-A1 POLYCARBONATE RESIN, AND OPTICAL LENS AND OPTICAL FILM USING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-06-22 — — US disclosed
EP-3372627-B1 METHOD OF PRODUCING THERMOPLASTIC RESIN MITSUBISHI GAS CHEMICAL CO (JP) 2020-05-27 — — EP disclosed
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