SCHEMBL16146356

SCHEMBL16146356

CC(C)(C)C(O)C(CCC(=O)O)NC(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.48
HTT P42858 1/20 0.48
FOLH1 Q04609 3/20 0.47
CASP1 P29466 1/20 0.47
SYK P43405 1/20 0.47
CTSL P07711 2/20 0.46
CTSS P25774 2/20 0.46
CTSB P07858 1/20 0.46
ELANE P08246 1/20 0.46
ATM Q13315 1/20 0.46
CTRB1 P17538 2/20 0.46
CTSK P43235 1/20 0.44

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
SCHEMBL143121 1.00 TRPM8 (0.48) TRPM8HTTFOLH1CASP1SYK
SCHEMBL5197791 0.87 CASP1 (0.52) TRPM8CASP1SYKCTSLCTSS
SCHEMBL5196289 0.86 TRPM8 (0.47) TRPM8HTTFOLH1CASP1SYK
SCHEMBL15132856 0.82 HTT (0.50) TRPM8HTTFOLH1CASP1CTSL
SCHEMBL11227787 0.82 HTT (0.52) TRPM8HTTFOLH1CASP1ATM
SCHEMBL10827930 0.81 CTSK (0.55) CTSLCTSSCTSBATMCTSK
SCHEMBL11255815 0.80 HTT (0.56) HTTFOLH1CASP1CTSLCTSS
SCHEMBL144787 0.79 ATM (0.42) TRPM8HTTFOLH1SYKCTSL
SCHEMBL1643448 0.79 CTSK (0.52) TRPM8SYKCTSLCTSSCTSB
SCHEMBL265046 0.79 ATM (0.56) HTTFOLH1CTSLCTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9737621-B2 MRI-visible hydrophobic copolymer CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-08-22 US disclosed
US-20140302324-A1 MRI-VISIBLE HYDROPHOBIC COPOLYMER CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2014-10-09 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-20140302324-A1 MRI-VISIBLE HYDROPHOBIC COPOLYMER PHF6, CD14, PGRMC2 TRPM8 2447/4885HTT 145/4885FOLH1 493/4885

“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.