SCHEMBL17497367

SCHEMBL17497367

C=CCCC(=O)O[C@@H](CNC(=O)[C@@H](CC=C)Cc1ccc(Cl)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.53
KLK7 P49862 3/20 0.39
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
ATM Q13315 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35

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
SCHEMBL17497370 1.00 L3MBTL1 (0.53) L3MBTL1KLK7PPARGPPARAATM
SCHEMBL2189806 0.88 L3MBTL1 (0.53) L3MBTL1KLK7ATMALDH1A1LMNA
SCHEMBL2189803 0.88 L3MBTL1 (0.53) L3MBTL1KLK7ATMALDH1A1LMNA
SCHEMBL17497670 0.80 L3MBTL1 (0.46) L3MBTL1PPARGATMCNR1CNR2
SCHEMBL17497671 0.80 L3MBTL1 (0.46) L3MBTL1PPARGATMCNR1CNR2
SCHEMBL17497666 0.80 L3MBTL1 (0.46) L3MBTL1PPARGATMCNR1CNR2
SCHEMBL17497201 0.79 L3MBTL1 (0.46) L3MBTL1PPARGPPARA
SCHEMBL17497198 0.79 L3MBTL1 (0.46) L3MBTL1PPARGPPARA
SCHEMBL12508089 0.79 L3MBTL1 (0.69) L3MBTL1PPARGPPARA
SCHEMBL2188918 0.79 L3MBTL1 (0.69) L3MBTL1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160046590-A1 SONIC HEDGEHOG MODULATORS MASSACHUSETTS INST TECHNOLOGY (US) 2016-02-18 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-20160046590-A1 SONIC HEDGEHOG MODULATORS SHH, GLI1, SMO L3MBTL1 188/4885KLK7 3688/4885PPARG 1902/4885

“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.