SCHEMBL11514239

SCHEMBL11514239

CS(=O)(=O)C(CCCCCCC(=O)O)CCCC(O)CCCCC(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.49
▸ FFAR1 O14842 2/20 0.49
▸ ACACB O00763 1/20 0.45
▸ ACACA Q13085 1/20 0.45
▸ ALOX5 P09917 1/20 0.38
▸ TBXA2R P21731 1/20 0.36
▸ PTGFR P43088 1/20 0.36
▸ PTGER2 P43116 1/20 0.36
▸ FAAH O00519 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ PTGER1 P34995 1/20 0.34
▸ PTGER4 P35408 1/20 0.34
▸ PTGER3 P43115 1/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ GSTK1 Q9Y2Q3 1/20 0.33

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
SCHEMBL11512502 0.86 FFAR4 (0.51) FFAR4FFAR1ACACBACACATBXA2R
SCHEMBL10728789 0.83 FFAR4 (0.73) FFAR4FFAR1FAAHALDH1A1PTPN1
SCHEMBL11515005 0.83 FFAR4 (0.73) FFAR4FFAR1FAAHALDH1A1PTPN1
SCHEMBL11515906 0.83 FFAR4 (0.73) FFAR4FFAR1FAAHALDH1A1PTPN1
SCHEMBL11603782 0.82 FFAR4 (0.47) FFAR4FFAR1ACACBACACAALOX5
SCHEMBL11620649 0.81 FFAR4 (0.51) FFAR4FFAR1ACACBACACAALOX5
SCHEMBL11516521 0.80 FFAR4 (0.50) FFAR4FFAR1ACACBACACAALOX5
SCHEMBL11515135 0.78 MAPT (0.50) FFAR4FFAR1TBXA2RPTGFRPTGER2
SCHEMBL11746247 0.78 FFAR4 (0.51) FFAR4FFAR1ACACBACACAALOX5
SCHEMBL11742346 0.78 FFAR4 (0.47) FFAR4FFAR1ACACBACACAALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4155908-A PSORIASIS, ANTICOAGULANTS MERCK & CO., INC. (US) 1979-05-22 — — US claimed
US-4155908-A PSORIASIS, ANTICOAGULANTS MERCK & CO., INC. (US) 1979-05-22 — — US disclosed
US-4128564-A 9-Thia- and oxothia- and 9-dioxothia-11,12-seco-prostaglandins MERCK & CO., INC. (US) 1978-12-05 — — US disclosed
US-4085125-A 9-Thia-, 9-oxothia-, and 9-dioxothia-11,12-seco-prostaglandins and processes MERCK & CO., INC. (US) 1978-04-18 — — US disclosed
US-4066675-A PSORIASIS, THROMBOSIS MERCK & CO., INC. (US) 1978-01-03 — — US disclosed
US-4018802-A SKIN DISEASES, GROWTH HORMONE STIMULANTS, THROMBUS PREVENTION, IMMUNOLOGY MERCK & CO., INC. (US) 1977-04-19 — — US disclosed
Send feedback