SCHEMBL12197281

SCHEMBL12197281

CCCc1ccc(C2CCC(C(=O)Oc3ccc(C4CCC(c5ccc(OCC)c(F)c5F)CC4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

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
▸ GLA P06280 1/20 0.34
▸ CTSL P07711 1/20 0.33
▸ CTSS P25774 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ PPARD Q03181 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRB2 P47870 1/20 0.31
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL11933227 0.96 CTSL (0.40) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL11933369 0.96 CTSL (0.40) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL12197140 0.93 CTSL (0.38) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL14922676 0.91 HPGD (0.47) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL12737145 0.90 HPGD (0.34) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL12742017 0.90 HPGD (0.34) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL12223940 0.89 HPGD (0.33) HPGDMEN1RAB9AKMT2AL3MBTL1
SCHEMBL12197319 0.88 HPGD (0.39) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL14922677 0.88 HPGD (0.43) HPGDSMN1; SMN2MEN1RAB9AKMT2A
SCHEMBL12197475 0.88 SMN1; SMN2 (0.35) HPGDSMN1; SMN2MEN1KMT2AGLA

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 3 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

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 HPGD 4261/4885SMN1; SMN2 3764/4885MEN1 2906/4885

“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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