SCHEMBL20802466

SCHEMBL20802466

Cc1ccc(C#Cc2cnc(-c3ccc4c(F)c(C#CC(F)(F)F)c(F)cc4c3)nc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.35
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
AAK1 Q2M2I8 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
SCHEMBL20813312 0.86 GRM2 (0.32) CYP11B1CYP11B2
SCHEMBL20813499 0.84 CA12 (0.31) GRM5
SCHEMBL20813702 0.83 GRM5 (0.32) GRM5
SCHEMBL20813529 0.82 ACACB (0.37) GRM5CYP11B1CYP11B2
SCHEMBL20813944 0.81
SCHEMBL20813942 0.81 CYP11B1 (0.38) CYP11B1CYP11B2
SCHEMBL20803269 0.80 NPC1 (0.34)
SCHEMBL20813521 0.79 GRM5 (0.32) GRM5
SCHEMBL20813752 0.78 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL20813900 0.77

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-10676669-B2 Compound having naphthalene ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2020-06-09 US disclosed
US-20190078019-A1 COMPOUND HAVING NAPHTHALENE RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2019-03-14 US disclosed
EP-3453697-A1 COMPOUND HAVING NAPHTHALENE RING, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2019-03-13 EP 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-10676669-B2 Compound having naphthalene ring, liquid crystal composition and liquid crystal display device PYM1, CXCR1, CPNE4 GRM5 3977/4885CYP11B1 1962/4885CYP11B2 1762/4885

“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.