SCHEMBL22563096

SCHEMBL22563096

Cc1ccc2c3ccc(C)cc3n(-c3cc(C#N)cc(-n4c5cc(C)ccc5c5ccc(C)cc54)c3-c3nc(C)nc(C)n3)c2c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP14 P54578 1/20 0.36
CYP19A1 P11511 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2A6 P11509 1/20 0.35
GRM2 Q14416 1/20 0.34
ITK Q08881 1/20 0.32
GRM5 P41594 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
SCHEMBL21108748 0.94 PTGER4 (0.36) USP14CYP19A1ALDH1A1CYP2A6GRM2
SCHEMBL21108006 0.91 USP14 (0.35) USP14ALDH1A1CYP2A6GRM5
SCHEMBL22563430 0.90 USP14 (0.38) USP14CYP19A1ALDH1A1CYP2A6GRM2
SCHEMBL19943041 0.89 CHEK1 (0.39) ALDH1A1CYP2A6GRM2
SCHEMBL19942583 0.88 CHEK1 (0.35) ALDH1A1GRM2
SCHEMBL21108351 0.87 CHEK1 (0.41) GRM2
SCHEMBL19943112 0.87 CHEK1 (0.35) GRM2GRM5
SCHEMBL19943043 0.86 CHEK1 (0.36)
SCHEMBL19943115 0.86 CHEK1 (0.34) GRM2
SCHEMBL21108749 0.85 KIF11 (0.36) CYP19A1GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11492344-B2 Organic molecules for use in organic optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2022-11-08 US disclosed
EP-3507285-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 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-11492344-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OCIAD2, OR51E2 USP14 4066/4885CYP19A1 2258/4885ALDH1A1 49/4885

“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.