SCHEMBL5855402

SCHEMBL5855402

CC(C)(OCCCCCCC(NC(=O)c1ccc(F)cc1)C(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 10/20 0.48
ALB P02768 1/20 0.45
CTSL P07711 2/20 0.45
CA2 P00918 3/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA9 Q16790 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
MMP2 P08253 1/20 0.41
MMP8 P22894 1/20 0.41
MMP12 P39900 1/20 0.41
ADAMTS5 Q9UNA0 1/20 0.41

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
SCHEMBL5857667 0.92 CTSL (0.44) FOLH1ALBCTSLCA2CA12
SCHEMBL5858508 0.90 TGM2 (0.45) FOLH1CA2CA12CA1CA9
SCHEMBL5857654 0.90 ALB (0.46) FOLH1ALBCA2CA12CA1
SCHEMBL5857630 0.90 ITGB3 (0.47) CA2CA12CA1CA9
SCHEMBL5856010 0.90 ITGB3 (0.47) CA2CA12CA1CA9
SCHEMBL5858377 0.90 ITGB3 (0.47) CA2CA12CA1CA9
SCHEMBL5855784 0.89 GRN (0.46) FOLH1ALBCA2CA12CA1
SCHEMBL5855896 0.82 CTSL (0.41) FOLH1ALBCTSLALDH1A1HPGD
SCHEMBL5855147 0.82 NR1H4 (0.41) CA2CA12CA1CA9ALDH1A1
SCHEMBL5857551 0.82 PPARG (0.40) ALBCA2CA12CA1CA9

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-7144906-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-12-05 US disclosed
US-7030143-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-18 US disclosed
US-7022723-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-04-04 US disclosed
EP-1634876-A2 Heterocyclic compounds for the treatment of hyperlipidemia agents Nippon Shinyaku Co., Ltd. (JP) 2006-03-15 EP disclosed
US-6998412-B2 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2006-02-14 US disclosed
US-20050009892-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2005-01-13 US disclosed
US-20050009785-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2005-01-13 US disclosed
US-20040162325-A1 Heterocyclic compounds KUWABARA KENJI (JP) 2004-08-19 US disclosed
US-20030166697-A1 Heterocyclic compounds NIPPON SHINYAKU CO., LTD. (JP) 2003-09-04 US disclosed
EP-1295875-A1 HETEROCYCLIC COMPOUNDS Nippon Shinyaku Co., Ltd. (JP) 2003-03-26 EP 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-20050009785-A1 Heterocyclic compounds LIPC, GPR119, APOB FOLH1 2019/4885ALB 631/4885CTSL 3295/4885
US-20050009892-A1 Heterocyclic compounds GPR119, LIPC, LIPE FOLH1 2679/4885ALB 1124/4885CTSL 3334/4885
US-20040162325-A1 Heterocyclic compounds LIPE, GPR119, LIPC FOLH1 2827/4885ALB 1460/4885CTSL 3811/4885
US-20030166697-A1 Heterocyclic compounds LIPE, GPR119, LIPC FOLH1 2827/4885ALB 1460/4885CTSL 3811/4885

“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.