SCHEMBL20074191

SCHEMBL20074191

CCc1c(C(F)(F)F)[nH]c2ncnn2c1=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
KDM5B Q9UGL1 1/20 0.37
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.30
PKM P14618 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
EGLN2 Q96KS0 1/20 0.30
SIRT5 Q9NXA8 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
SCHEMBL20074286 0.79 ALDH1A1 (0.46) TSHRKDM5BALDH1A1KDM4EHPGD
SCHEMBL20074195 0.79 LMNA (0.35) TSHRKDM5BHPGDLMNAPKM
SCHEMBL2429495 0.75 ENPP1 (0.43)
SCHEMBL20075884 0.74 KDM5B (0.35) TSHRKDM5BALDH1A1KDM4EHPGD
SCHEMBL20074197 0.70 TSHR (0.41) TSHRKDM5BALDH1A1KDM4EHPGD
SCHEMBL2453480 0.69 MBOAT4 (0.39) KDM5B
SCHEMBL2422627 0.69 TSHR (0.40) TSHRALDH1A1TDP1SIRT5
SCHEMBL11714380 0.67 GAA (0.40) TSHRALDH1A1KDM4ETDP1SIRT5
SCHEMBL2464506 0.66 MBOAT4 (0.40) KDM5B
SCHEMBL20074180 0.65 TSHR (0.45) TSHRKDM5BALDH1A1KDM4EHPGD

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 TSHR 4342/4885KDM5B 2/4885ALDH1A1 1399/4885
US-10975084-B2 KDM5 inhibitors KDM5A, KDM5B, KDM5C TSHR 4342/4885KDM5B 2/4885ALDH1A1 1399/4885

“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.