SCHEMBL10164683

SCHEMBL10164683

CCC1CCC(C(=O)Oc2ccc(-c3ccc(-c4ccc(C5CO5)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.33
MEN1 O00255 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
OXTR P30559 1/20 0.30
AVPR1A P37288 1/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL12786637 0.87 MEN1 (0.35) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL13586125 0.86 ALOX5AP (0.35) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL12823695 0.86 ALOX5AP (0.35) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL8971424 0.85 HPGD (0.41) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL12717614 0.85 ALOX5AP (0.33) HPGDMEN1KMT2A
SCHEMBL12822555 0.84 ALOX5AP (0.39) OXTRAVPR1A
SCHEMBL12823979 0.84 ALOX5AP (0.39) OXTRAVPR1A
SCHEMBL12822910 0.83 HPGD (0.39) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL12823327 0.83 HPGD (0.39) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL12823346 0.82 PDE4A (0.33)

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 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-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, HCN3, FZD7 HPGD 4487/4885MEN1 3734/4885RAB9A 1665/4885

“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.