SCHEMBL12196992

SCHEMBL12196992

CCCc1ccc(C2CCC(OCC3CCC(c4ccc(-c5ccc(OCC)c(F)c5F)c(F)c4F)CC3)CC2)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
GPR119 Q8TDV5 6/20 0.33
HCRTR2 O43614 3/20 0.32
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
FPR2 P25090 1/20 0.30
NAAA Q02083 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30

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
SCHEMBL12197104 1.00 CTSL (0.39) CTSLCTSSCTSKGPR119HCRTR2
SCHEMBL12197428 0.93 GPR119 (0.35) CTSLCTSSCTSKGPR119HCRTR2
SCHEMBL12197390 0.93 GPR119 (0.35) CTSLCTSSCTSKGPR119HCRTR2
SCHEMBL11933177 0.93 CTSL (0.41) CTSLCTSSCTSKALOX5APFEN1
SCHEMBL11933323 0.93 CTSL (0.41) CTSLCTSSCTSKALOX5APFEN1
SCHEMBL14922638 0.91 GPR119 (0.37) GPR119HCRTR2ALOX5APFEN1FPR2
SCHEMBL14922575 0.91 GPR119 (0.37) GPR119HCRTR2ALOX5APFEN1FPR2
SCHEMBL11933300 0.90 CTSL (0.41) CTSLCTSSCTSKALOX5APFEN1
SCHEMBL11933201 0.90 CTSL (0.41) CTSLCTSSCTSKALOX5APFEN1
SCHEMBL11933119 0.90 CTSS (0.45) CTSLCTSSCTSKALOX5APFEN1

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-8435422-B2 Five-ring compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-05-07 US disclosed
US-8435422-B2 Five-ring compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-05-07 US disclosed
US-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-10-06 US disclosed
US-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-10-06 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-20110240919-A1 FIVE-RING COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE NCAPD3, CCND3, ZKSCAN2 CTSL 3768/4885CTSS 2260/4885CTSK 1982/4885

“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.