SCHEMBL20074319

SCHEMBL20074319

CC(C)c1c(-c2ccc(C(F)(F)F)cc2)[nH]c2ncnn2c1=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 6/20 0.47
KDM5A P29375 1/20 0.41
COMT P21964 1/20 0.37
TSHR P16473 1/20 0.37
SLC11A2 P49281 1/20 0.34
MBOAT4 Q96T53 1/20 0.34
PDE2A O00408 2/20 0.34
TDP1 Q9NUW8 1/20 0.33
FPR2 P25090 1/20 0.33
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33

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
SCHEMBL20074328 0.86 KDM5B (0.44) KDM5BTSHR
SCHEMBL20074315 0.86 KDM5B (0.51) KDM5BKDM5ASLC11A2
SCHEMBL31676960 0.86 KDM5B (0.51) KDM5BKDM5ASLC11A2
SCHEMBL20074320 0.85 KDM5B (0.46) KDM5BTSHRTLR9TLR8TLR7
SCHEMBL20074233 0.85 KDM5B (0.52) KDM5BTSHRTLR9TLR8TLR7
SCHEMBL20074339 0.85 KDM5B (0.50) KDM5BTSHR
SCHEMBL21681712 0.82 CCNB2 (0.49) KDM5BTSHRTLR8TLR7
SCHEMBL21721741 0.82 KDM5B (0.48) KDM5BTSHR
SCHEMBL21721761 0.82 KDM5B (0.46) KDM5BTSHRTDP1
SCHEMBL21721717 0.82 KDM5B (0.46) KDM5BTSHRTDP1TLR9TLR8

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 7 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
EP-3525785-B1 KDM5 INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-08-27 EP disclosed
US-10975084-B2 KDM5 inhibitors MERCK SHARP & DOHME CORP. (US) 2021-04-13 US disclosed
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
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 1/4885COMT 2293/4885
US-10975084-B2 KDM5 inhibitors KDM5A, KDM5B, KDM5C KDM5B 2/4885KDM5A 1/4885COMT 2293/4885

“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.