SCHEMBL22158372

SCHEMBL22158372

Cc1ccc2c3ccc(C)cc3n(-c3cc(C#N)cc(-n4c5cc(C)ccc5c5ccc(C)cc54)c3-c3c(F)c(F)c(F)c(F)c3F)c2c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
USP14 P54578 1/20 0.35
ALDH1A1 P00352 1/20 0.33
CYP2A6 P11509 1/20 0.33
GRM4 Q14833 1/20 0.31
PDE9A O76083 1/20 0.30
CYP19A1 P11511 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
SCHEMBL22158373 0.94 PDE9A (0.34) USP14GRM4PDE9A
SCHEMBL22156442 0.89 ALDH1A1 (0.33) ALDH1A1CYP2A6PDE9A
SCHEMBL22156453 0.86 GRM4 (0.34) USP14ALDH1A1CYP2A6GRM4PDE9A
SCHEMBL22158371 0.86 PDE9A (0.34) ALDH1A1PDE9A
SCHEMBL23299808 0.84 ALDH1A1 (0.35) USP14ALDH1A1CYP2A6
SCHEMBL21414227 0.83 ALDH1A1 (0.39) USP14ALDH1A1CYP2A6PDE9ACYP19A1
SCHEMBL22156444 0.83 KIF11 (0.36)
SCHEMBL22156450 0.82 PDE9A (0.36) USP14GRM4PDE9A
SCHEMBL19912352 0.82 ALDH1A1 (0.38) USP14ALDH1A1CYP2A6CYP19A1
SCHEMBL26776845 0.82 PDE9A (0.40) USP14ALDH1A1CYP2A6GRM4PDE9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 USP14 4726/4885ALDH1A1 1882/4885CYP2A6 2606/4885

“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.