SCHEMBL12196815

SCHEMBL12196815

CCOc1ccc(-c2ccc(C3CCC(CCC4CCC(c5ccc(C)c(F)c5F)CC4)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 9/20 0.36
▸ FPR2 P25090 3/20 0.33
▸ CNR1 P21554 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ ALOX5AP P20292 3/20 0.31
▸ FEN1 P39748 3/20 0.31
▸ AAK1 Q2M2I8 1/20 0.31
▸ KDM1A O60341 2/20 0.30
▸ FGFR1 P11362 1/20 0.30
▸ FGFR2 P21802 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
SCHEMBL10091343 0.95 OPRL1 (0.38) OPRL1CNR1CNR2KDM1A
SCHEMBL14922512 0.94 FPR2 (0.36) OPRL1FPR2CNR1CNR2ALOX5AP
SCHEMBL11933105 0.94 FPR2 (0.36) FPR2ALOX5APFEN1AAK1KDM1A
SCHEMBL11933324 0.92 ALOX5AP (0.37) FPR2CNR1CNR2ALOX5APFEN1
SCHEMBL11933111 0.92 ALOX5AP (0.37) FPR2CNR1CNR2ALOX5APFEN1
SCHEMBL12197368 0.91 OPRL1 (0.36) OPRL1CNR1CNR2KDM1A
SCHEMBL11933108 0.91 CTSL (0.33) OPRL1FPR2
SCHEMBL11933106 0.91 CTSL (0.33) OPRL1FPR2
SCHEMBL12196829 0.91 OPRL1 (0.33) OPRL1FPR2CNR1CNR2ALOX5AP
SCHEMBL12196576 0.90 FPR2 (0.34) FPR2ALOX5APFEN1KDM1AFGFR1

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-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

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 OPRL1 1746/4885FPR2 1970/4885CNR1 307/4885

“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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