SCHEMBL23926974

SCHEMBL23926974

Cc1cc(C#N)cc(C)c1Oc1ccc(N)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.51
POLB P06746 2/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
KEAP1 Q14145 1/20 0.48
ALDH1A1 P00352 1/20 0.48
BRCA1 P38398 1/20 0.48
HBB P68871 1/20 0.48
HSD17B10 Q99714 1/20 0.48
RAB9A P51151 1/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
ABCC3 O15438 1/20 0.42
ESR1 P03372 1/20 0.42
CYP1A2 P05177 1/20 0.42
PGR P06401 1/20 0.42
CHRM2 P08172 1/20 0.42
ABCB1 P08183 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42

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
SCHEMBL30079731 1.00 KDM4E (0.51) KDM4EPOLBMEN1KMT2AKEAP1
SCHEMBL12594180 0.83 KEAP1 (0.52) KDM4EPOLBMEN1KMT2AKEAP1
SCHEMBL4064001 0.80 KDM4E (0.63) KDM4EPOLBMEN1KMT2AKEAP1
SCHEMBL1979598 0.78 KEAP1 (0.69) KDM4EPOLBMEN1KMT2AKEAP1
SCHEMBL30079611 0.78 CYP2C9 (0.42) POLBKEAP1ALDH1A1RAB9ACYP2C9
SCHEMBL23927064 0.78 CYP2C9 (0.42) POLBKEAP1ALDH1A1RAB9ACYP2C9
SCHEMBL23927093 0.77 L3MBTL1 (0.51) KDM4EMEN1KMT2AALDH1A1HTT
SCHEMBL6507078 0.75 KDM4E (0.63) KDM4EPOLBMEN1KMT2AKEAP1
SCHEMBL20155520 0.74 KEAP1 (0.46) KDM4EPOLBMEN1KMT2AKEAP1
SCHEMBL3887260 0.73 KDM4E (0.43) KDM4EPOLBALDH1A1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230124087-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS HOFFMANN-LA ROCHE INC. (US) 2023-04-20 US disclosed
EP-4139306-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-La Roche AG (CH) 2023-03-01 EP disclosed
CN-115380032-A KV3 enhancers for the treatment of cognitive disorders 豪夫迈·罗氏有限公司 2022-11-22 CN disclosed
WO-2021214090-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2021-10-28 WO disclosed
EP-3901152-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS F. Hoffmann-La Roche AG (CH) 2021-10-27 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-20230124087-A1 KV3 ENHANCERS FOR THE TREATMENT OF COGNITIVE DISORDERS KCNN3, KCNA4, KCNA3 KDM4E 200/4885POLB 3774/4885MEN1 2507/4885

“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.