SCHEMBL6891317

SCHEMBL6891317

O=C(O)[C@H](Cc1ccccc1)NC(=O)N(CCO)CCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.53
MME P08473 7/20 0.49
ACE P12821 5/20 0.49
LMNA P02545 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CPA1 P15085 3/20 0.47
ACE2 Q9BYF1 3/20 0.47
PTPN1 P18031 1/20 0.47
NAALAD2 Q9Y3Q0 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45

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
SCHEMBL6895388 1.00 LPAR1 (0.53) LPAR1MMEACELMNANPSR1
SCHEMBL27538262 1.00 LPAR1 (0.53) LPAR1MMEACELMNANPSR1
SCHEMBL6895621 0.95 MME (0.57) LPAR1MMEACECPA1ACE2
SCHEMBL6896715 0.94 ACE (0.54) LPAR1MMEACECPA1ACE2
SCHEMBL6890555 0.93 LPAR1 (0.48) LPAR1MMEACELMNACPA1
SCHEMBL7051183 0.93 ALDH1A1 (0.55) LPAR1MMEACELMNANPSR1
SCHEMBL27538344 0.93 LPAR1 (0.48) LPAR1MMEACELMNACPA1
SCHEMBL6893733 0.92 LPAR1 (0.56) LPAR1MMEACELMNANPSR1
SCHEMBL27559925 0.92 LPAR1 (0.56) LPAR1MMEACELMNANPSR1
SCHEMBL6897944 0.90 KMT2A (0.61) 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 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 4229/4885MME 1516/4885ACE 1063/4885

“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.