SCHEMBL5653978

SCHEMBL5653978

N[C@@H](CO)C(=O)NCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 2/20 0.53
KMT2A Q03164 1/20 0.53
EGFR P00533 2/20 0.52
SRC P12931 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51
CYP2C19 P33261 1/20 0.51
SLC1A1 P43005 1/20 0.49
MME P08473 1/20 0.49
MMP2 P08253 1/20 0.49
GAA P10253 1/20 0.49
FNTA P49354 1/20 0.48
FNTB P49356 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48

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
SCHEMBL47278 1.00 MMP8 (0.53) MMP8KMT2AEGFRSRCCYP1A2
SCHEMBL1697377 1.00 MMP8 (0.53) MMP8KMT2AEGFRSRCCYP1A2
SCHEMBL18952189 0.86 SPHK1 (0.62) MMP8KMT2AEGFRSRCCYP1A2
SCHEMBL7413310 0.86 ALPI (0.61) MMP8KMT2AEGFRSRCMME
SCHEMBL3114367 0.86 ALPI (0.61) MMP8KMT2AEGFRSRCMME
SCHEMBL12240253 0.84 KMT2A (0.55) MMP8KMT2AEGFRSRCMME
SCHEMBL2742291 0.84 KMT2A (0.55) MMP8KMT2AEGFRSRCMME
SCHEMBL20569813 0.84 TPSAB1 (0.58) CYP1A2CYP2D6CYP2C9TSHRCYP2C19
SCHEMBL16289699 0.84 MMP2 (0.68) MMP8KMT2AEGFRSRCCYP1A2
Hydrochloric Acid SCHEMBL3385081 0.84 MMP8 (0.59) MMP8KMT2AEGFRSRCMME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106543018-A The method for preparing scheme for lacosamide 迪比斯实验股份有限公司 2017-03-29 CN disclosed
US-20070208166-A1 Tao Kinase Modulators And Method Of Use EXELIXIS, INC. (US) 2007-09-06 US disclosed
US-6114534-A REACTING A KETONE DERIVATIVE OF CARBAMOYL SUBSTITUTED HETEROCYCLE WITH PHOSPHORANE, FOLLOWED BY ACIDIFICATION TO FORM AN ANTICOAGULANT ELI LILLY AND COMPANY (US) 2000-09-05 US disclosed
US-6075147-A OMEGA-PHENYL-OMEGA-(3-PYRIDYL)-OMEGA-ALKENOIC ACID DERIVATIVES BEARING A CARBAMOYL SUBSTITUTED OXAZOLYL OR OXAZOLINYL GROUP ON THE PHENYL RING IS USEFUL FOR THROMBOXANE RECEPTOR ANTAGONSIM OR THROMBOXANE SYNTHASE INHIBITOR ELI LILLY AND COMPANY (US) 2000-06-13 US disclosed
US-6031095-A Intermediates in the preparation of substituted alkenoic acids ELI LILLY AND COMPANY (US) 2000-02-29 US disclosed
US-5990308-A Intermediates in the preparation of substituted alkenoic acids ELI LILLY AND COMPANY (US) 1999-11-23 US disclosed
US-5849766-A Carbamoyl substituted heterocycles ELI LILLY AND COMPANY (US) 1998-12-15 US disclosed
US-5849922-A Preparation of substituted alkenoic acids ELI LILLY AND COMPANY (US) 1998-12-15 US disclosed
EP-0816361-A2 Preparation of substituted alkenoic acids ELI LILLY AND COMPANY (US) 1998-01-07 EP disclosed
EP-0811621-A2 Carbamoyl substituted oxazoles as thromboxane receptor antagonists ELI LILLY AND COMPANY (US) 1997-12-10 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-20070208166-A1 Tao Kinase Modulators And Method Of Use TAOK1, TAOK3, MAP3K6 MMP8 1252/4885KMT2A 2240/4885EGFR 893/4885

“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.