SCHEMBL11893371

SCHEMBL11893371

CCCCCCCCCCCc1ccc(-c2ccc(C(=O)Oc3cc(F)c(C#N)c(F)c3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.50
RARA P10276 2/20 0.50
MAPT P10636 2/20 0.50
RARG P13631 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MTOR P42345 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47
THRA P10827 3/20 0.44
THRB P10828 3/20 0.44
PRSS1 P07477 1/20 0.41
ACR P10323 1/20 0.41

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
SCHEMBL11893340 1.00 RARB (0.50) RARBRARAMAPTRARGMEN1
SCHEMBL11911605 1.00 RARB (0.50) RARBRARAMAPTRARGMEN1
SCHEMBL11893359 1.00 RARB (0.50) RARBRARAMAPTRARGMEN1
SCHEMBL11893343 1.00 RARB (0.50) RARBRARAMAPTRARGMEN1
SCHEMBL11893423 1.00 RARB (0.50) RARBRARAMAPTRARGMEN1
SCHEMBL1367878 0.99 RARB (0.49) RARBRARAMAPTRARGMEN1
SCHEMBL11893604 0.96 RARB (0.48) RARBRARAMAPTRARGMEN1
SCHEMBL8066396 0.96 RARB (0.46) RARBRARAMAPTRARGMEN1
SCHEMBL14525759 0.92 RARB (0.42) RARBRARAMAPTRARGALDH1A1
SCHEMBL11893356 0.91 MAPT (0.47) RARBRARAMAPTRARGMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8603595-B2 Liquid crystalline compound, liquid crystal composition, liquid crystal element, and liquid crystal display device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-12-10 US disclosed
WO-2012105380-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND LIQUID CRYSTAL DISPLAY DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-08-09 WO disclosed
US-20120194775-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND LIQUID CRYSTAL DISPLAY DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-08-02 US disclosed
US-20120194775-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND LIQUID CRYSTAL DISPLAY DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-08-02 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-20120194775-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND LIQUID CRYSTAL DISPLAY DEVICE CXCR1, SFXN1, CRY1 RARB 3134/4885RARA 3206/4885MAPT 351/4885

“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.