SCHEMBL15088747

SCHEMBL15088747

CCCCC[C@](C)(F)CC

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.43
LPAR1 Q92633 1/20 0.43
LPAR3 Q9UBY5 1/20 0.43
TSHR P16473 1/20 0.39
THRB P10828 1/20 0.39
FAAH O00519 8/20 0.37
CES1 P23141 5/20 0.36
FDPS P14324 4/20 0.36
GGPS1 O95749 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SMPD1 P17405 1/20 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
SCHEMBL21505107 0.97 CES2 (0.46) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL15508644 0.97 CES2 (0.46) CES2LPAR1LPAR3TSHRTHRB
Ammonia Solution, Strong SCHEMBL9443891 0.95 CES2 (0.45) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL15160145 0.91
SCHEMBL24926244 0.88 CES2 (0.48) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL21004248 0.88 CES2 (0.48) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL21004295 0.88 CES2 (0.48) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL7849144 0.83 CES2 (0.45) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL14479235 0.83 CES2 (0.45) CES2LPAR1LPAR3TSHRTHRB
SCHEMBL14532686 0.83 CES2 (0.45) CES2LPAR1LPAR3TSHRTHRB

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-20130172558-A1 NAPROXEN-BASED CHIRAL COMPOUNDS AND LIQUID CRYSTAL DISPLAY APPLICATIONS CITIZEN FINETECH MIYOTA CO., LTD. (JP) 2013-07-04 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-20130172558-A1 NAPROXEN-BASED CHIRAL COMPOUNDS AND LIQUID CRYSTAL DISPLAY APPLICATIONS CRY1, CRY2, ALOX5 CES2 217/4885LPAR1 514/4885LPAR3 754/4885

“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.