SCHEMBL15835212

SCHEMBL15835212

C=CCn1c(CNC(=O)c2cccc(C)c2)cnc1SCC(=O)Nc1cccc(C(=O)OC(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ MAPT P10636 6/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.52
▸ TSHR P16473 3/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ LMNA P02545 3/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ RECQL P46063 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ ALOX15 P16050 1/20 0.43

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
SCHEMBL1896673 0.88 SMN1; SMN2 (0.64) ALDH1A1KDM4EMAPTSMN1; SMN2TSHR
SCHEMBL16500319 0.68 PTGES (0.54) ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL18559353 0.67 SMN1; SMN2 (1.00) ALDH1A1KDM4EMAPTSMN1; SMN2TSHR
SCHEMBL17131975 0.67 HTT (0.53) KDM4EMAPTSMN1; SMN2TSHRLMNA
SCHEMBL17131918 0.64 KDM4E (0.50) KDM4EMAPTSMN1; SMN2TSHRLMNA
SCHEMBL30774051 0.63 ALDH1A1 (0.68) ALDH1A1MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL1898074 0.63 ALDH1A1 (0.68) ALDH1A1MAPTSMN1; SMN2TSHRKMT2A
SCHEMBL6057062 0.63 RAB9A (0.58) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL14970814 0.62 SMN1; SMN2 (0.71) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL18559263 0.62 MAPT (1.00) ALDH1A1MAPTSMN1; SMN2TSHRMEN1

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-9504676-B2 Molecules inhibiting a metabolic pathway involving the Syk protein tyrosine kinase and method for identifying said molecules CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-11-29 — — US disclosed
US-9504676-B2 Molecules inhibiting a metabolic pathway involving the Syk protein tyrosine kinase and method for identifying said molecules CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-11-29 — — US disclosed
US-20140179679-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-06-26 — — US disclosed
US-20140179679-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-06-26 — — 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-20140179679-A1 MOLECULES INHIBITING A METABOLIC PATHWAY INVOLVING THE SYK PROTEIN TYROSINE KINASE AND METHOD FOR IDENTIFYING SAID MOLECULES SYK, BTK, TYRO3 ALDH1A1 3595/4885KDM4E 891/4885MAPT 4486/4885

“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.

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