SCHEMBL7901007

SCHEMBL7901007

COC(=O)CC(CC(=O)OC)[Si](C)(C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 8/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 2/20 0.40
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
NR1I2 O75469 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 1/20 0.38
ABCB1 P08183 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL7891736 0.82 KMT2A (0.44) KCNA5POLBKMT2AALDH1A1NR1I2
SCHEMBL15437776 0.72 GABBR2 (0.47) KMT2AMAPTTSHRLMNA
SCHEMBL2347309 0.72 HPGD (0.57) KCNA5POLBKMT2AALDH1A1HPGD
SCHEMBL7995142 0.71 ALDH1A1 (0.67) KCNA5POLBKMT2AALDH1A1HPGD
SCHEMBL12473253 0.71 KCNA5 (0.65) KCNA5POLBKMT2AALDH1A1HPGD
SCHEMBL5522123 0.70 KCNA5 (0.64) KCNA5KMT2AALDH1A1HPGDMAPT
SCHEMBL9909376 0.70 KCNA5 (0.64) KCNA5KMT2AALDH1A1HPGDMAPT
SCHEMBL29740346 0.70 KCNA5 (0.40) KCNA5POLBKMT2AALDH1A1MAPT
SCHEMBL6230959 0.70 ALDH1A1 (0.47) KCNA5POLBKMT2AALDH1A1HPGD
SCHEMBL6862384 0.69 KCNA5 (0.51) KCNA5KMT2AALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288268-B1 REACTION OF OLEFIN WITH ALCOHOL, OXYGEN AND CARBON MONOXIDE IN THE PRESENCE OF CATALYST FOR BISALKOXYCARBONYLATION WITH NOBLE MEYAL AND PHOSPHINE CHALCOGENIDE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2001-09-11 US disclosed
US-6184390-B1 Catalyst for bisalkoxycarbonylation of olefins, and method for production of succinate derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2001-02-06 US disclosed
US-6159891-A Catalyst for bisalkoxycarbonylation of olefins, and method for production of succinate derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-12-12 US disclosed