SCHEMBL514967

SCHEMBL514967

CN[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NC(CCCNC=NN)C(=O)c1nc2ccccc2s1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2 P00734 9/20 0.60
PRKD3 O94806 2/20 0.47
F10 P00742 2/20 0.47
PLAU P00749 2/20 0.47
PLAT P00750 2/20 0.47
PRKCG P05129 2/20 0.47
PRKCB P05771 2/20 0.47
F7 P08709 2/20 0.47
PRKCA P17252 2/20 0.47
PRKCH P24723 2/20 0.47
PRKCI P41743 2/20 0.47
PRKCE Q02156 2/20 0.47
PRKCQ Q04759 2/20 0.47
PRKCZ Q05513 2/20 0.47
PRKCD Q05655 2/20 0.47
PRKD1 Q15139 2/20 0.47
PRSS1 P07477 2/20 0.46
TPSAB1 Q15661 2/20 0.46

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
SCHEMBL5860115 0.89 F2 (0.57) F2PRSS1TPSAB1
SCHEMBL5860178 0.89 F2 (0.59) F2PRSS1TPSAB1
SCHEMBL514966 0.88 F2 (0.59) F2PRKD3F10PLAUPLAT
SCHEMBL30171117 0.88 F2 (0.76) F2PRKD3F10PLAUPLAT
SCHEMBL5862727 0.86 F2 (0.57) F2PRSS1TPSAB1
SCHEMBL5861466 0.86 F2 (0.55) F2PRKD3F10PLAUPLAT
SCHEMBL5862699 0.85 F2 (0.52) F2PRKD3F10PLAUPLAT
SCHEMBL5862711 0.84 F2 (0.56) F2PRSS1TPSAB1
SCHEMBL8939669 0.84 F2 (0.54) F2PRKD3F10PLAUPLAT
SCHEMBL7205443 0.82 F2 (0.49) F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4401441-B2 2010-01-20 JP claimed
JP-2001502360-A 2001-02-20 JP claimed
EP-0948308-A1 METHODS FOR TREATING SKIN PIGMENTATION JOHNSON & JOHNSON CONSUMER PRODUCTS, INC. (US) 1999-10-13 EP claimed
WO-1999004752-A9 METHODS FOR TREATING SKIN PIGMENTATION JOHNSON & JOHNSON CONSUMER (US) 1999-04-08 WO claimed
WO-1999004752-A2 METHODS FOR TREATING SKIN PIGMENTATION JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 1999-02-04 WO claimed
US-20120027706-A1 METHODS FOR TREATING SKIN PIGMENTATION SHAPIRO STANLEY S (US) 2012-02-02 US disclosed
US-8039026-B1 Methods for treating skin pigmentation JOHNSON & JOHNSON CONSUMER COMPANIES, INC (US) 2011-10-18 US disclosed
US-20080249029-A1 Administering (S)-N-Methyl-D-phenylalanyl-N-[4-[(aminoiminomethyl)aminol-1-(2-benzothiazolylcarbonyl)butyl-L-prolinamide as a protease activated receptor-2 modulator SHAPIRO STANLEY S 2008-10-09 US disclosed
EP-1037653-B1 COMPOSITIONS AND METHODS FOR REGULATING PHAGOCYTOSIS AND ICAM-1 EXPRESSION JOHNSON & JOHNSON CONSUMER (US) 2006-09-06 EP disclosed
US-6750229-B2 ADMINISTERING TO A MAMMAL A PIGMENTATION-CHANGING EFFECTIVE AMOUNT OF A BOWMAN-BIRK INHIBITOR OR OF NATURAL EXTRACT CONTAINING A BOWMAN-BIRK INHIBITOR JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2004-06-15 US disclosed
EP-0948308-B1 METHODS FOR TREATING SKIN PIGMENTATION JOHNSON & JOHNSON CONSUMER (US) 2004-02-25 EP disclosed
US-20020197244-A1 Compositions and methods for regulating phagocytosis and ICAM-1 expression SEIBERG MIRI (US) 2002-12-26 US disclosed
US-6323219-B1 PRODRUGS AND PEPTIDES FOR ANTIINFLAMMATORY AGENTS ORTHO-MCNEIL PHARMACEUTICAL, INC. 2001-11-27 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 (3 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-20120027706-A1 METHODS FOR TREATING SKIN PIGMENTATION TYR, MC1R, NQO1 F2 1151/4885PRKD3 334/4885F10 2783/4885
US-20080249029-A1 Administering (S)-N-Methyl-D-phenylalanyl-N-[4-[(aminoiminomethyl)aminol-1-(2-benzothiazolylcarbonyl)butyl-L-prolinamide as a protease activated receptor-2 modulator MC1R, F2RL1, F2R F2 914/4885PRKD3 1630/4885F10 2445/4885
US-20020197244-A1 Compositions and methods for regulating phagocytosis and ICAM-1 expression ICAM1, CD47, VCAM1 F2 2338/4885PRKD3 2914/4885F10 1009/4885

“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.