SCHEMBL40193

SCHEMBL40193

CC(C)(C)c1cc(CCC(=O)OCOC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O.CC(C)(C)c1cc(CCC(=O)OCOC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O.CC(C)(C)c1cc(CCC(=O)OCOC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O.CC(OC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)OC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.51
KMT2A Q03164 5/20 0.48
MEN1 O00255 4/20 0.43
HMGCR P04035 2/20 0.42
HTT P42858 2/20 0.39
PKM P14618 1/20 0.39
ALDH1A1 P00352 4/20 0.39
TSHR P16473 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
MAPK1 P28482 2/20 0.39
BLM P54132 2/20 0.39
ATM Q13315 2/20 0.39
HIF1A Q16665 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
USP2 O75604 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39
LMNA P02545 3/20 0.39
AGTR1 P30556 1/20 0.39

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
SCHEMBL10966364 1.00 GAA (0.51) GAAKMT2AMEN1HMGCRHTT
SCHEMBL1083078 0.94 GAA (0.56) GAAKMT2AMEN1HMGCRHTT
SCHEMBL11595437 0.92 GAA (0.44) GAAKMT2AMEN1HMGCRHTT
SCHEMBL858494 0.90 GAA (0.60) GAAKMT2AMEN1HMGCRHTT
Ethane SCHEMBL9814026 0.89 GAA (0.59) GAAKMT2AMEN1HMGCRHTT
Methane SCHEMBL5968168 0.89 GAA (0.59) GAAKMT2AMEN1HMGCRHTT
SCHEMBL10786630 0.86 GAA (0.56) GAAKMT2AMEN1HMGCRHTT
SCHEMBL206902 0.85 GAA (0.50) GAAKMT2AMEN1HMGCRHTT
SCHEMBL28554709 0.85 GAA (0.55) GAAKMT2AMEN1HMGCRHTT
SCHEMBL8399002 0.85 GAA (0.55) GAAKMT2AMEN1HMGCRHTT

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 522 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1885787-B1 PHOSPHITE ADDITIVES IN POLYOLEFINS PHILLIPS PETROLEUM CO (US) 2018-01-10 EP claimed
EP-1846367-B1 ALIPHATIC, CYCLOALIPHATIC OR (CYCLO)ALIPHATIC DIISOCYANATES THAT ARE STABLE IN STORAGE EVONIK DEGUSSA GMBH (DE) 2016-03-09 EP claimed
US-20120149815-A1 Transparent Layer Forming Polymer PROMERUS LLC (US) 2012-06-14 US claimed
US-20100168329-A1 ALIPHATIC, CYCLOALIPHATIC OR (CYCLO)ALIPHATIC DIISOCYANATES THAT ARE STABLE IN STORAGE DEGUSSA GMBH (DE) 2010-07-01 US claimed
EP-1858492-B1 ORAL OSMOTIC DOSAGE FORM HAVING A HIGH FLUX MEMBRANE ALZA CORP (US) 2008-11-12 EP claimed
EP-1885787-A1 PHOSPHITE ADDITIVES IN POLYOLEFINS Philips Petroleum Company (US) 2008-02-13 EP claimed
EP-1858492-A2 ORAL OSMOTIC DOSAGE FORM HAVING A HIGH FLUX MEMBRANE Alza Corporation (US) 2007-11-28 EP claimed
US-7157511-B2 Phosphite additives in polyolefins CHEVRON PHILLIPSCHEMICAL COMPANY LP 2007-01-02 US claimed
WO-2006124018-A1 PHOSPHITE ADDITIVES IN POLYOLEFINS PHILLIPS PETROLEUM COMPANY (US) 2006-11-23 WO claimed
US-7135511-B2 Phosphite additives in polyolefins CHEVRON PHILLIPS CHEMICAL COMPANY, L.P. (US) 2006-11-14 US claimed
US-4233208-A OXIDATION RESISTANCE, RADIATION RESISTANCE CIBA-GEIGY CORPORATION (US) 1980-11-11 US claimed
US-4207229-A STABILIZING POLYPROPYLENE AGAINST THERNAL, OXIDATIVE AND ULTRAVIOLET LIGHT DEGRADATION CIBA-GEIGY CORPORATION (US) 1980-06-10 US claimed
US-4195016-A STABILIZERS OF POLYMERS AGAINST THERMAL, OXIDATIVE, AND ULTRAVIOLET LIGHT DEGRADATION CIBA-GEIGY CORPORATION (US) 1980-03-25 US claimed
US-4182704-A STABILIZERS CIBA-GEIGY CORPORATION (US) 1980-01-08 US claimed
US-4180497-A STABILIZERS FOR ORGANIC POLYMERS AGAINST THERMAL, OXIDATIVE AND UV LIGHT DEGRADATION CIBA-GEIGY CORPORATION (US) 1979-12-25 US claimed
US-4147645-A STERICALLY HINDERED PHENOL STABILIZER ADDITIVE FOR RESIN XEROX CORPORATION (US) 1979-04-03 US claimed
US-4117178-A PHENOLIC ANTIOXIDANTS FOR NON-POLYMERIC HALOGEN COMPOUNDS DURING IMPREGNATION OF STYRENE POLYMER PARTICLES ARCO POLYMERS, INC. (US) 1978-09-26 US claimed
US-4101326-A Process for making stabilized polyesters used in radiation-sensitive compositions for lithographic plates having improved wear life including hindered phenols and phosphoric acid esters EASTMAN KODAK COMPANY (US) 1978-07-18 US claimed
US-3935164-A NICKEL 3,5-DI-TERT-ALKYL 4-HYDROXYBENZOATE, AND A BENZOPHENONE OR BENZOTRIAZOLE CIBA-GEIGY CORPORATION (US) 1976-01-27 US claimed
US-3933736-A HOMO- AND CO-POLYMERS OF ETHYLENE, PROPYLENE, BUTENE-1, PENTENE-1, AND 4-METHYLPENTENE-1 WITH ETHYL ACRYLATE OR VINYL ACETATE UBE INDUSTRIES, LTD. (JA) 1976-01-20 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100168329-A1 ALIPHATIC, CYCLOALIPHATIC OR (CYCLO)ALIPHATIC DIISOCYANATES THAT ARE STABLE IN STORAGE DDT, AADAC, SCD GAA 405/4885KMT2A 2933/4885MEN1 2047/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.