SCHEMBL20074119

SCHEMBL20074119

CC(C)c1c(-c2cn[nH]c2)[nH]c2ncnn2c1=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 4/20 0.46
KDM5A P29375 3/20 0.41
TSHR P16473 2/20 0.38
TLR8 Q9NR97 2/20 0.35
TLR7 Q9NYK1 2/20 0.35
TLR9 Q9NR96 1/20 0.35
ADORA2B P29275 4/20 0.33
ADORA2A P29274 3/20 0.33
ADORA1 P30542 3/20 0.33
MTOR P42345 2/20 0.32
ALDH1A1 P00352 1/20 0.32
SIRT5 Q9NXA8 1/20 0.32
ROCK2 O75116 1/20 0.31
PIK3CA P42336 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
FLT3 P36888 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
SCHEMBL20074337 0.83 KDM5B (0.44) KDM5BKDM5ATSHRTLR8TLR7
SCHEMBL21681711 0.81 KDM5B (0.48) KDM5BKDM5ATSHRTLR8TLR7
SCHEMBL20074277 0.81 KDM5B (0.42) KDM5BKDM5ATSHRADORA2BADORA2A
SCHEMBL21721735 0.80 KDM5B (0.47) KDM5BKDM5ATSHRTLR8TLR7
SCHEMBL20074331 0.80 KDM5B (0.43) KDM5BTSHRTLR8TLR7TLR9
SCHEMBL21681712 0.79 CCNB2 (0.49) KDM5BTSHRTLR8TLR7ADORA2B
SCHEMBL20074113 0.79 KDM5B (0.44) KDM5BTSHRADORA2BADORA2AALDH1A1
SCHEMBL20074328 0.79 KDM5B (0.44) KDM5BTSHR
SCHEMBL20074303 0.79 CCNB2 (0.47) KDM5BKDM5ATSHRALDH1A1FLT3
SCHEMBL20074336 0.78 KDM5B (0.47) KDM5BKDM5ATSHRTLR8TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3525785-B1 KDM5 INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-08-27 EP claimed
US-10975084-B2 KDM5 inhibitors MERCK SHARP & DOHME CORP. (US) 2021-04-13 US disclosed
US-20200048258-A1 KDM5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-02-13 US disclosed
WO-2018071283-A1 KDM5 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-04-19 WO 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 (2 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-20200048258-A1 KDM5 INHIBITORS KDM5A, KDM5B, KDM5C KDM5B 2/4885KDM5A 1/4885TSHR 4342/4885
US-10975084-B2 KDM5 inhibitors KDM5A, KDM5B, KDM5C KDM5B 2/4885KDM5A 1/4885TSHR 4342/4885

“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.