SCHEMBL2449022

SCHEMBL2449022

C1CCCCCC(P(C2CCCCCCCCCCC2)C2CCCCCCCCCCC2)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MGLL Q99685 1/20 0.32
GAA P10253 1/20 0.30
PKM P14618 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL26953 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL301131 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL14675991 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL3175920 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL9634079 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL301767 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL5511391 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL9633702 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL22157999 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM
SCHEMBL3184929 1.00 ALDH1A1 (0.33) ALDH1A1HSD17B10MGLLGAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10774024-B2 Process for preparing an unsaturated carboxylic acid salt BASF SE (DE) 2020-09-15 US disclosed
EP-3442939-B1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2020-08-26 EP disclosed
US-20190112251-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2019-04-18 US disclosed
EP-3442939-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2019-02-20 EP disclosed
EP-3142995-B1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT USING AN ARYLOXIDE BASF SE (DE) 2018-03-21 EP disclosed
WO-2017178282-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT BASF SE (DE) 2017-10-19 WO disclosed
US-9758461-B2 Process for preparing an unsaturated carboxylic acid salt using an aryloxide BASF SE (DE) 2017-09-12 US disclosed
US-20170107166-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT USING AN ARYLOXIDE BASF SE (DE) 2017-04-20 US disclosed
EP-3142995-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT USING AN ARYLOXIDE BASF SE (DE) 2017-03-22 EP disclosed
WO-2015173295-A1 PREPARING AN UNSATURATED CARBOXYLIC ACID SALT FROM AN ALKENE AND CARBON DIOXIDE USING A COVALENTLY IMMOBILIZED TRANSITION METAL COMPLEX BASF SE (DE) 2015-11-19 WO disclosed
WO-2015173296-A1 PREPARING AN UNSATURATED CARBOXYLIC ACID SALT FROM AN ALKENE AND CARBON DIOXIDE USING A HETEROGENEOUS BASE BASF SE (DE) 2015-11-19 WO disclosed
US-8642803-B2 Preparation of ethylenically unsaturated carboxylic salts by carboxylation of alkenes BASF SE (DE) 2014-02-04 US disclosed
US-20110218359-A1 PREPARATION OF ETHYLENICALLY UNSATURATED CARBOXYLIC SALTS BY CARBOXYLATION OF ALKENES BASF SE (DE) 2011-09-08 US disclosed
US-5792884-A HEATING PHOSPHINE DIHALIDE IN PRESENCE OF POWDERED SILICON YIELDS TERTIARY PHOSPHINE AND LIQUID SILICON TETRAHALIDES WHICH CAN BE REMOVE BY DISTILLATION AND USED AS INTERMEDIATES FOR PURE SILICON AND ORGANOSILICON COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 1998-08-11 US disclosed
EP-0548682-B1 Process for the preparation of tertiary phosphines BASF AG (DE) 1996-11-06 EP disclosed
EP-0548682-A1 Process for the preparation of tertiary phosphines BASF Aktiengesellschaft (DE) 1993-06-30 EP disclosed
EP-0212991-B1 IMPROVED RHODIUM CATALYZED HYDROFORMYLATION OF ALPHA-SUBSTITUTED ALPHA-OLEFINS EXXON CHEMICAL PATENTS INC. (US) 1992-05-27 EP disclosed
EP-0212991-A1 Improved rhodium catalyzed hydroformylation of alpha-substituted alpha-olefins EXXON CHEMICAL PATENTS INC. (US) 1987-03-04 EP disclosed
US-4642388-A TRICYLLOALKYL PHOSPHINE LIGANDS, HIGH SELECTIVITY EXXON CHEMICAL PATENTS INC. (US) 1987-02-10 US disclosed
US-4625068-A STERICALLY HINDERED PHOSPHINE LIGNANDS; CATALYSTS EXXON CHEMICAL PATENTS INC. (US) 1986-11-25 US disclosed

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

For each of this compound's patents that has machine-readable text (4 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-20170107166-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT USING AN ARYLOXIDE ACOX1, ALOX12, SCO2 ALDH1A1 113/4885HSD17B10 131/4885MGLL 1615/4885
US-20110218359-A1 PREPARATION OF ETHYLENICALLY UNSATURATED CARBOXYLIC SALTS BY CARBOXYLATION OF ALKENES ARCN1, COPE, ELL ALDH1A1 135/4885HSD17B10 737/4885MGLL 3318/4885
US-20190112251-A1 PROCESS FOR PREPARING AN UNSATURATED CARBOXYLIC ACID SALT AP2S1, AP1S1, EBP ALDH1A1 820/4885HSD17B10 284/4885MGLL 1729/4885
US-10774024-B2 Process for preparing an unsaturated carboxylic acid salt AP2S1, AP1S1, EBP ALDH1A1 820/4885HSD17B10 284/4885MGLL 1729/4885

“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.