SCHEMBL7051183

SCHEMBL7051183

O=C(O)[C@H](Cc1ccc(F)cc1)NC(=O)N(CCO)CCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.55
POLB P06746 1/20 0.49
GPR34 Q9UPC5 2/20 0.48
LPAR1 Q92633 1/20 0.48
MME P08473 7/20 0.47
ACE P12821 6/20 0.47
CPA1 P15085 3/20 0.45
ACE2 Q9BYF1 3/20 0.45
PTPN1 P18031 1/20 0.44
CA2 P00918 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL27538262 0.93 LPAR1 (0.53) POLBLPAR1MMEACECPA1
SCHEMBL6891317 0.93 LPAR1 (0.53) POLBLPAR1MMEACECPA1
SCHEMBL6895388 0.93 LPAR1 (0.53) POLBLPAR1MMEACECPA1
SCHEMBL6895621 0.91 MME (0.57) LPAR1MMEACECPA1ACE2
SCHEMBL6896715 0.89 ACE (0.54) LPAR1MMEACECPA1ACE2
SCHEMBL6890555 0.88 LPAR1 (0.48) GPR34LPAR1MMEACECPA1
SCHEMBL27538344 0.88 LPAR1 (0.48) GPR34LPAR1MMEACECPA1
SCHEMBL6893733 0.85 LPAR1 (0.56) POLBLPAR1MMEACECPA1
SCHEMBL27559925 0.85 LPAR1 (0.56) POLBLPAR1MMEACECPA1
SCHEMBL6897944 0.85 KMT2A (0.61) ALDH1A1LPAR1MMEACECA2

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 ALDH1A1 1309/4885POLB 2155/4885GPR34 1753/4885

“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.