SCHEMBL6897026

SCHEMBL6897026

CN(C)CCNC(=O)[C@H](Cc1ccc(-c2ccccc2)cc1)NC(=O)N(CCO)CCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
KIFC1 Q9BW19 11/20 0.48
MME P08473 1/20 0.44
ACE P12821 1/20 0.44
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
MMP8 P22894 2/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43

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
SCHEMBL6891324 0.96 TACR2 (0.44) L3MBTL1KIFC1CTSSCTSKMMP8
SCHEMBL6898098 0.93 OPRM1 (0.49) KIFC1MMP8MMP2MMP9
SCHEMBL7753429 0.93 OPRM1 (0.49) KIFC1MMP8MMP2MMP9
SCHEMBL6898089 0.92 MMP8 (0.42) L3MBTL1KIFC1MMP8
SCHEMBL6890087 0.92 AVPR1A (0.52) L3MBTL1KIFC1MMP8
SCHEMBL27538326 0.92 MMP8 (0.42) L3MBTL1KIFC1MMP8
SCHEMBL6891355 0.92 KIFC1 (0.45) L3MBTL1KIFC1MMP8
SCHEMBL27538358 0.92 AVPR1A (0.52) L3MBTL1KIFC1MMP8
SCHEMBL6897535 0.91 KMT2A (0.51) KIFC1CTSSCTSKMMP9
SCHEMBL6898000 0.90 MEN1 (0.43) KIFC1CTSSCTSKMMP8

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 L3MBTL1 3448/4885KIFC1 4614/4885MME 1516/4885

“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.