SCHEMBL19793864

SCHEMBL19793864

CCCCCCCc1cc2ccc(CCC3CCC(CCCCCC)CC3)c(F)c2c(=O)o1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
CEL P19835 4/20 0.37
ELANE P08246 3/20 0.35
HCAR2 Q8TDS4 4/20 0.34
CYP1A2 P05177 1/20 0.34
CNR2 P34972 1/20 0.33
GAA P10253 2/20 0.32
ALOX15 P16050 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL19793865 1.00 MAPT (0.45) MAPTCELELANEHCAR2CYP1A2
SCHEMBL19793857 0.99 MAPT (0.43) MAPTCELELANEHCAR2CYP1A2
SCHEMBL19793868 0.98 MAPT (0.45) MAPTCELELANEHCAR2CYP1A2
SCHEMBL19793853 0.97 MAPT (0.40) MAPTCELELANEHCAR2CYP1A2
SCHEMBL19793871 0.96 MAPT (0.45) MAPTCELELANEHCAR2CNR2
SCHEMBL19793856 0.96 MAPT (0.40) MAPTCELELANEHCAR2CYP1A2
SCHEMBL19793858 0.96 MAPT (0.45) MAPTCELELANEHCAR2CNR2
SCHEMBL19793875 0.95 MAPT (0.44) MAPTCELELANEHCAR2CNR2
SCHEMBL19793867 0.94 MAPT (0.43) MAPTCELELANEHCAR2CNR2
SCHEMBL19793852 0.94 MAPT (0.37) MAPTCELHCAR2CYP1A2CNR2

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-10428273-B2 Liquid crystal compound having benzopyran skeleton, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2019-10-01 US disclosed
US-20180022998-A1 LIQUID CRYSTAL COMPOUND HAVING BENZOPYRAN SKELETON, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-01-25 US disclosed
US-20180022998-A1 LIQUID CRYSTAL COMPOUND HAVING BENZOPYRAN SKELETON, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-01-25 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 (2 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-10428273-B2 Liquid crystal compound having benzopyran skeleton, liquid crystal composition, and liquid crystal display device PIEZO1, PYCARD, NLRP1 MAPT 161/4885CEL 361/4885ELANE 2653/4885
US-20180022998-A1 LIQUID CRYSTAL COMPOUND HAVING BENZOPYRAN SKELETON, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE PIEZO1, NLRP1, PYCARD MAPT 175/4885CEL 337/4885ELANE 2588/4885

“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.