SCHEMBL21215134

SCHEMBL21215134

OCCOc1ccc(C2(c3ccccc3OCCO)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 10/20 0.48
ALDH1A1 P00352 2/20 0.46
RECQL P46063 1/20 0.46
GAA P10253 1/20 0.41
ALOX5AP P20292 1/20 0.40
FFAR4 Q5NUL3 2/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR7 P34969 1/20 0.37
NR1I2 O75469 1/20 0.36
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 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
SCHEMBL29502080 1.00 PDK2 (0.48) PDK2ALDH1A1RECQLGAAALOX5AP
SCHEMBL17050236 0.90 PDK2 (0.54) PDK2ALDH1A1RECQLGAAALOX5AP
SCHEMBL194556 0.90 PDK2 (0.54) PDK2ALDH1A1RECQLGAAALOX5AP
SCHEMBL30211372 0.90 PDK2 (0.54) PDK2ALDH1A1RECQLGAAALOX5AP
SCHEMBL29351148 0.90 PDK2 (0.54) PDK2ALDH1A1RECQLGAAALOX5AP
SCHEMBL21215149 0.89 PDK2 (0.47) PDK2ALDH1A1RECQLGAAALOX5AP
SCHEMBL20411195 0.87 ALDH1A1 (0.55) PDK2ALDH1A1RECQLGAAALOX5AP
SCHEMBL2783176 0.86 PDK2 (0.46) PDK2ALDH1A1RECQLALOX5APKDM4E
SCHEMBL29459450 0.86 PDK2 (0.46) PDK2ALDH1A1RECQLALOX5APKDM4E
SCHEMBL23127881 0.86 PDK2 (0.47) PDK2KDM4ESMN1; SMN2MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10962793-B2 Method of producing thermoplastic resin MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-03-30 US disclosed
US-10955680-B2 Method of producing thermoplastic resin MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-03-23 US disclosed
EP-3372627-B1 METHOD OF PRODUCING THERMOPLASTIC RESIN MITSUBISHI GAS CHEMICAL CO (JP) 2020-05-27 EP disclosed
EP-3536728-A1 METHOD OF PRODUCING THERMOPLASTIC RESIN MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-09-11 EP disclosed
US-20190235258-A1 METHOD OF PRODUCING THERMOPLASTIC RESIN MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-08-01 US disclosed