SCHEMBL12823680

SCHEMBL12823680

CCOc1ccc(OC(=O)C2CCC(c3ccc(C4CCC(C(C)O)CC4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ACACB O00763 5/20 0.34
▸ GLA P06280 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ GAA P10253 2/20 0.31
▸ POLB P06746 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ MAPT P10636 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
SCHEMBL13586146 1.00 HPGD (0.41) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL14922676 0.91 HPGD (0.47) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL13586086 0.90 HPGD (0.40) HPGDRAB9AACACBGLALMNA
SCHEMBL12223357 0.89 HPGD (0.41) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL12822831 0.89 POLB (0.35) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL12823004 0.89 POLB (0.35) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL12821099 0.89 ACACB (0.35) SMN1; SMN2ACACBIDO1LMNAFFAR4
SCHEMBL12822095 0.89 HPGD (0.39) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL13586384 0.89 HPGD (0.39) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL12823224 0.88 HPGD (0.38) HPGDACACBFFAR4

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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 — — US disclosed
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — WO 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 HPGD 4781/4885SMN1; SMN2 3745/4885MEN1 2496/4885

“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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