SCHEMBL6895993

SCHEMBL6895993

CC(=O)SCCN(CCCc1ccccc1)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.53
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
TSHR P16473 1/20 0.46
ACE P12821 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
LTA4H P09960 2/20 0.39
MME P08473 2/20 0.39

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
SCHEMBL27538356 1.00 LPAR1 (0.53) LPAR1KMT2AMEN1TSHRACE
SCHEMBL27543517 0.94 LPAR1 (0.48) LPAR1KMT2AMEN1TSHRACE
SCHEMBL6898352 0.94 LPAR1 (0.48) LPAR1KMT2AMEN1TSHRACE
SCHEMBL6891444 0.94 LPAR1 (0.48) LPAR1KMT2AMEN1TSHRACE
SCHEMBL6889315 0.90 LPAR1 (0.43) LPAR1KMT2AMEN1TSHRCYP2D6
SCHEMBL6894902 0.90 LPAR1 (0.43) LPAR1KMT2AMEN1TSHR
SCHEMBL6897390 0.88 LPAR1 (0.52) LPAR1KMT2AMEN1TSHRLTA4H
SCHEMBL27559903 0.88 LPAR1 (0.52) LPAR1KMT2AMEN1TSHRLTA4H
SCHEMBL6891035 0.87 PPARG (0.45) LPAR1KMT2AMEN1TSHRACE
SCHEMBL27559944 0.87 PPARG (0.45) LPAR1KMT2AMEN1TSHRACE

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 5 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
CN-1299344-A Novel urea derivatives SANTEN PHARCEUMATICAL CO LTD (JP) 2001-06-13 CN 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 4229/4885KMT2A 4759/4885MEN1 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.