SCHEMBL14948979

SCHEMBL14948979

CC[C@H](C)[C@H](NC(=O)Nc1ccc(Br)cc1F)C(=O)OC(C)(C)C

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 10/20 0.72
POLB P06746 2/20 0.56
ALDH1A1 P00352 3/20 0.52
MAPT P10636 1/20 0.52
PKM P14618 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
NPC1 O15118 2/20 0.44
LMNA P02545 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 1/20 0.43
AAK1 Q2M2I8 2/20 0.43
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 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
SCHEMBL29758804 0.88 FPR2 (0.67) FPR2POLBALDH1A1MAPTPKM
SCHEMBL22175140 0.88 FPR2 (0.67) FPR2POLBALDH1A1MAPTPKM
SCHEMBL14902659 0.88 FPR2 (0.67) FPR2POLBALDH1A1MAPTPKM
SCHEMBL19566147 0.84 FPR2 (0.82) FPR2POLBALDH1A1MAPTPKM
SCHEMBL14948919 0.84 FPR2 (1.00) FPR2POLBALDH1A1MAPTPKM
SCHEMBL22506221 0.84 FPR2 (1.00) FPR2POLBALDH1A1MAPTPKM
SCHEMBL14937931 0.84 FPR2 (1.00) FPR2POLBALDH1A1MAPTPKM
SCHEMBL14889990 0.83 FPR2 (0.80) FPR2POLBALDH1A1MAPTPKM
SCHEMBL14948920 0.83 FPR2 (0.80) FPR2POLBALDH1A1MAPTPKM
SCHEMBL14902579 0.82 FPR2 (0.69) FPR2POLBALDH1A1MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3088385-A1 ARYL UREA DERIVATIVES AS N-FORMYL PEPTIDE RECEPTOR LIKE-1 (FPRL-1) RECEPTOR MODULATORS ALLERGAN, INC. (US) 2016-11-02 EP disclosed
EP-2776389-B1 ARYL UREA DERIVATIVES AS N-FORMYL PEPTIDE RECEPTOR LIKE-1 (FPRL-1) RECEPTOR MODULATORS ALLERGAN INC (US) 2016-09-21 EP disclosed
US-8816076-B2 Aryl urea derivatives as N-formyl peptide receptor like-1 (FPRL-1) receptor modulators ALLERGAN, INC. (US) 2014-08-26 US disclosed
US-8541577-B2 Aryl urea derivatives as N-formyl peptide receptors like-1 (FPRL-1) receptor modulators ALLERGAN, INC. (US) 2013-09-24 US disclosed
WO-2013070600-A1 ARYL UREA DERIVATIVES AS N-FORMYL PEPTIDE RECEPTOR LIKE-1 (FPRL-1) RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-05-16 WO disclosed
US-20130123496-A1 ARYL UREA DERIVATIVES AS N-FORMYL PEPTIDE RECEPTORS LIKE-1 (FPRL-1) RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-05-16 US 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-20130123496-A1 ARYL UREA DERIVATIVES AS N-FORMYL PEPTIDE RECEPTORS LIKE-1 (FPRL-1) RECEPTOR MODULATORS FPR1, FPR3, FPR2 FPR2 3/4885POLB 4372/4885ALDH1A1 3881/4885

“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.