SCHEMBL22745291

SCHEMBL22745291

Cc1cc(C#N)cc2c1[nH]c1ccc(C#N)cc12

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 3/20 0.55
▸ CHUK O15111 1/20 0.49
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ PARP1 P09874 1/20 0.42
▸ FASN P49327 1/20 0.40
▸ IMPDH2 P12268 1/20 0.39
▸ IMPDH1 P20839 1/20 0.39
▸ MAPK10 P53779 1/20 0.38
▸ RIPK1 Q13546 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ GSK3A P49840 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ CDK5 Q00535 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ CYP19A1 P11511 1/20 0.36

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
SCHEMBL29060637 0.80 AR (0.55) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL30523211 0.80 AR (0.55) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL29402283 0.80 CHUK (0.68) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL606784 0.80 CHUK (0.68) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL30545930 0.80 CHUK (0.68) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL15202514 0.79 MEN1 (0.53) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL28264381 0.79 AR (0.54) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL28589834 0.78 CHUK (0.66) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL16923633 0.77 CHUK (0.57) ARCHUKMEN1KMT2AL3MBTL1
SCHEMBL25956920 0.75 CHUK (0.48) ARCHUKMEN1KMT2AL3MBTL1

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-20200377537-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-03 — — 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-20200377537-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME LEF1, GPX1, OCIAD1 AR 4347/4885CHUK 4215/4885MEN1 143/4885

“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.

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