SCHEMBL10043352

SCHEMBL10043352

CCCCCCCCC1CCC(c2cc(F)c(C3CCC(C4CCC(c5cc(F)c(F)c(F)c5)CC4)CC3)c(F)c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
GAA P10253 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
SPHK1 Q9NYA1 3/20 0.32
CNR1 P21554 1/20 0.32
CYP2C9 P11712 1/20 0.32
OPRL1 P41146 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 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
SCHEMBL10043157 1.00 MAPT (0.35) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL10043162 1.00 MAPT (0.35) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL10043350 1.00 MAPT (0.35) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL10043353 1.00 MAPT (0.35) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL872811 0.99 MEN1 (0.34) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL10043080 0.99 MEN1 (0.34) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL10043089 0.99 MEN1 (0.34) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL872812 0.99 MEN1 (0.34) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL9763955 0.95 MAPT (0.38) MAPTGAAMEN1KMT2ASPHK1
SCHEMBL9763861 0.95 MAPT (0.38) MAPTGAAMEN1KMT2ASPHK1

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-8470199-B2 Five-ring liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-06-25 US disclosed
US-20120074355-A1 FIVE-RING LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2012-03-29 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-20120074355-A1 FIVE-RING LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE HTR3D, KIF23, CCND3 MAPT 667/4885GAA 4829/4885MEN1 1110/4885

“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.