SCHEMBL6897525

SCHEMBL6897525

CC(=O)SCCN(CCc1ccccc1)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.41
MME P08473 2/20 0.40
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ACE P12821 1/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA9 Q16790 2/20 0.37
CA2 P00918 1/20 0.37
CPA1 P15085 1/20 0.36
CPA2 P48052 1/20 0.36
CPA4 Q9UI42 1/20 0.36
PTGES O14684 1/20 0.36
LIMK1 P53667 1/20 0.36
LIMK2 P53671 1/20 0.36
FOLH1 Q04609 1/20 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
SCHEMBL6897519 1.00 LPAR1 (0.41) LPAR1MMEMEN1NPC1RAB9A
SCHEMBL27538252 0.91 LPAR1 (0.50) LPAR1MMEKMT2AACECA12
SCHEMBL6897868 0.91 LPAR1 (0.50) LPAR1MMEMEN1NPC1RAB9A
SCHEMBL6896981 0.91 LPAR1 (0.50) LPAR1MMEKMT2AACECA12
SCHEMBL27559916 0.89 LPAR1 (0.42) LPAR1MMEMEN1NPC1RAB9A
SCHEMBL6896160 0.89 LPAR1 (0.42) LPAR1MMEMEN1NPC1RAB9A
SCHEMBL6891444 0.86 LPAR1 (0.48) LPAR1MMEMEN1NPC1RAB9A
SCHEMBL6898352 0.86 LPAR1 (0.48) LPAR1MMEMEN1NPC1RAB9A
SCHEMBL27543517 0.86 LPAR1 (0.48) LPAR1MMEMEN1NPC1RAB9A
SCHEMBL6897951 0.85 LPAR1 (0.39) LPAR1MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730784-B2 AS THERAPEUTIC AGENTS FOR AUTOIMMUNE DISEASES SUCH AS RHEUMATOID ARTHRITIS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2004-05-04 US disclosed
US-20020198376-A1 Novel urea derivatives SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-26 US disclosed
US-6492370-B1 Urea derivatives and pharmaceutical compositions thereof SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-10 US disclosed
EP-1072591-A1 NOVEL UREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-01-31 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 (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-20020198376-A1 Novel urea derivatives TNF, CTH, CFH LPAR1 4229/4885MME 1516/4885MEN1 4882/4885

“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.