SCHEMBL13002425

SCHEMBL13002425

CCCC1CCC(c2ccc(-c3ccc(C(=O)Oc4cc(F)c(C(F)(F)F)c(F)c4)cc3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.50
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
LMNA P02545 1/20 0.48
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
DGAT1 O75907 4/20 0.35
SOAT1 P35610 1/20 0.35
MCHR1 Q99705 1/20 0.35
P2RY14 Q15391 5/20 0.35
FFAR4 Q5NUL3 1/20 0.35
FASN P49327 3/20 0.34
CCR2 P41597 1/20 0.33
KCNH2 Q12809 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL13002426 0.94 CYP2C9 (0.50) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL15744936 0.90 CYP2C9 (0.47) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL14961180 0.90 CYP2C9 (0.45) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL8025496 0.87 CYP2C9 (0.56) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL8052168 0.87 CYP2C9 (0.56) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL12032083 0.86 CYP2C9 (0.41) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL12977520 0.85 CYP2C9 (0.46) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL15744382 0.85 CYP2C9 (0.47) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL7723020 0.84 CYP2C9 (0.53) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL8471095 0.84 CYP2C9 (0.53) CYP2C9ALDH1A1MAPTLMNAMEN1

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
EP-2123623-B1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-08-07 EP disclosed
US-7846514-B2 Liquid crystal compound, liquid crystal composition and, liquid crystal display device CHISSO CORPORATION (JP) 2010-12-07 US disclosed
US-20100073621-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 2010-03-25 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 (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-20100073621-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT TRPV4, TRPV5, ZKSCAN2 CYP2C9 2077/4885ALDH1A1 4257/4885MAPT 179/4885

“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.