SCHEMBL8430429

SCHEMBL8430429

C=C(CC(=O)OCC1CO1)C(=O)OC(C)C

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MGLL Q99685 5/20 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
SCHEMBL8644341 0.88 ALDH1A1 (0.57) ALDH1A1TP53CYP3A4MGLL
SCHEMBL4338206 0.84 ALDH1A1 (0.59) ALDH1A1TP53CYP3A4MGLL
SCHEMBL221571 0.84 ALDH1A1 (0.62) ALDH1A1TP53CYP3A4MGLL
Phosphine SCHEMBL28055753 0.82 ALDH1A1 (0.61) ALDH1A1TP53CYP3A4MGLL
SCHEMBL8662726 0.79 ALDH1A1 (0.43) ALDH1A1
Ether SCHEMBL11860765 0.79 ALDH1A1 (0.57) ALDH1A1TP53CYP3A4MGLL
SCHEMBL6265408 0.79 ALDH1A1 (0.49) ALDH1A1TP53CYP3A4MGLL
Glycerin SCHEMBL28154727 0.78 ALDH1A1 (0.51) ALDH1A1TP53CYP3A4MGLL
SCHEMBL4897393 0.78 ALDH1A1 (0.64) ALDH1A1TP53CYP3A4MGLL
SCHEMBL394803 0.77 ALDH1A1 (0.53) ALDH1A1TP53CYP3A4MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5872164-A PHASE-REPLACED AND DEHYDRATED PRODUCT OF A MIXTURE COMPRISING A PIGMENT, WATER, THERMOPLASTIC RESIN AND EITHER A BORATE, A MODIFIED SILOXANE OR AN ORGAANIC FLUORINE COMPOUND TOYO INK MANUFACTURING CO., LTD. (JP) 1999-02-16 US disclosed
US-5811492-A HAVING EXCELLENT HEAT, FIRE, CHEMICAL AND IMPACT RESISTANCE, MECHANICAL STRENGTH, AND MOLDABILITY; CONTAINING AMINO GROUPS, HYDROGENATED BLOCK COPOLYMER AND A POLYAMIDE RESIN GENERAL ELECTRIC COMPANY (US) 1998-09-22 US disclosed
US-5523358-A REACTING POLYOLEFIN WITH ETHYLENICALLY UNSATURATED COMPOUND IN THE PRESENCE OF FREE RADICAL INITIATOR MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1996-06-04 US disclosed
CN-1031278-C Modified polyolefin particles and process for preparation thereof MITSUI PETROCHEMICAL IND (JP) 1996-03-13 CN disclosed
EP-0370753-B1 Modified polyolefin particles and process for preparation thereof MITSUI PETROCHEMICAL IND (JP) 1995-01-18 EP disclosed
CN-1043144-A Modified polyolefin particles and preparation method thereof MITSUI PETROCHEMICAL IND (JP) 1990-06-20 CN disclosed
EP-0370753-A2 Modified polyolefin particles and process for preparation thereof MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-05-30 EP disclosed