SCHEMBL11933228

SCHEMBL11933228

CCOc1ccc(-c2ccc(C3CCC(C(=O)Oc4ccc(C)c(F)c4F)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.40
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ GLA P06280 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ FPR2 P25090 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ MAPK1 P28482 1/20 0.31

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
SCHEMBL11933370 1.00 HPGD (0.40) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL12197143 0.97 HPGD (0.39) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL12197293 0.96 HPGD (0.43) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL15381608 0.94 HPGD (0.43) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL15381541 0.94 HPGD (0.43) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL10091365 0.93 HPGD (0.41) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL11933374 0.92 SCN9A (0.36) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL11933230 0.92 SCN9A (0.36) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL14922546 0.91 HPGD (0.41) HPGDKMT2AMEN1RAB9AL3MBTL1
SCHEMBL12196535 0.91 SMN1; SMN2 (0.36) HPGDKMT2AMEN1GLASMN1; SMN2

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-8580147-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-11-12 — — US disclosed
US-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-07-05 — — 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-20120168677-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, OCIAD1, LEO1 HPGD 3893/4885KMT2A 2912/4885MEN1 1685/4885

“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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