SCHEMBL9864331

SCHEMBL9864331

CCCCP(=O)(CCCC)OP(=O)(CCCC)CCCC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TRPM8 Q7Z2W7 7/20 0.42
CYP3A4 P08684 1/20 0.42
GABBR2 O75899 1/20 0.41
GABRR1 P24046 1/20 0.41
GABBR1 Q9UBS5 1/20 0.41
LPAR3 Q9UBY5 5/20 0.40
LPAR2 Q9HBW0 2/20 0.40
FAAH O00519 1/20 0.39
LPAR1 Q92633 2/20 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
SCHEMBL7130147 0.81 PPARD (0.35) HPGDSMN1; SMN2TRPM8CYP3A4LPAR3
SCHEMBL18998194 0.81 FAAH (0.41) HPGDSMN1; SMN2TRPM8CYP3A4GABBR2
SCHEMBL575551 0.80 FAAH (0.48) HPGDSMN1; SMN2TRPM8CYP3A4GABBR2
SCHEMBL18998193 0.79 FAAH (0.39) HPGDSMN1; SMN2TRPM8CYP3A4GABBR2
SCHEMBL18998192 0.79 GABBR2 (0.41) HPGDSMN1; SMN2TRPM8GABBR2GABRR1
SCHEMBL575224 0.78 TSHR (0.46) HPGDSMN1; SMN2TRPM8CYP3A4LPAR3
SCHEMBL5491031 0.78 CYP3A4 (0.50) HPGDSMN1; SMN2TRPM8CYP3A4GABBR2
SCHEMBL575549 0.76 CYP3A4 (0.61) HPGDSMN1; SMN2CYP3A4LPAR3LPAR2
SCHEMBL575171 0.76 CYP3A4 (0.48) HPGDSMN1; SMN2TRPM8CYP3A4GABBR2
SCHEMBL5485224 0.76 CYP3A4 (0.54) HPGDSMN1; SMN2TRPM8CYP3A4LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5068351-A PROCESS FOR THE PREPARATION OF N OCTAHYDROPENTA (6) PYRROLE CARBOXYLATES HOECHST AKTIENGESELLSCHAFT (DE) 1991-11-26 US disclosed
EP-0135182-B1 PROCESS FOR THE PRODUCTION OF N-ALKYLATED DIPEPTIDES AND OF THEIR ESTERS HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-27 EP disclosed
EP-0135183-B1 PROCESS FOR THE PREPARATION OF COMPOUNDS CONTAINING CARBOXYLIC ACID AMIDE GROUPS, ESPECIALLY OF PEPTIDES HOECHST AKTIENGESELLSCHAFT (DE) 1988-03-30 EP disclosed
EP-0056618-B1 PROCESS FOR PREPARING COMPOUNDS THAT CONTAIN CARBOXYAMIDE GROUPS, ESPECIALLY PEPTIDES HOECHST AKTIENGESELLSCHAFT (DE) 1985-08-28 EP disclosed
EP-0135182-A2 Process for the production of N-alkylated dipeptides and of their esters HOECHST AKTIENGESELLSCHAFT (DE) 1985-03-27 EP disclosed
EP-0135183-A2 Process for the preparation of compounds containing carboxylic acid amide groups, especially of peptides HOECHST AKTIENGESELLSCHAFT (DE) 1985-03-27 EP disclosed
US-4426325-A Process for the preparation of compounds containing carboxylic acid amide groups, in particular or peptides HOECHST AKTIENGESELLSCHAFT (DE) 1984-01-17 US disclosed
EP-0056618-A1 Process for preparing compounds that contain carboxyamide groups, especially peptides HOECHST AKTIENGESELLSCHAFT (DE) 1982-07-28 EP disclosed
US-4244893-A FIREPROOFING; FINISHES FOR TEXTILES HOECHST AKTIENGESELLSCHAFT (DE) 1981-01-13 US disclosed
EP-0000024-A1 Polyadducts containing phosphorus and their application in the flameproofing of textile materials HOECHST AKTIENGESELLSCHAFT (DE) 1978-12-20 EP disclosed