SCHEMBL21721750

SCHEMBL21721750

CC(C)c1c(-c2cccc(Cl)c2)[nH]c2ncnn2c1=O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 8/20 0.49
EGLN2 Q96KS0 1/20 0.42
TSHR P16473 1/20 0.39
PGR P06401 2/20 0.38
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
IDO1 P14902 1/20 0.36
CHEK1 O14757 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
HSD17B10 Q99714 1/20 0.35
JAK2 O60674 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35

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
SCHEMBL31676999 1.00 KDM5B (0.49) KDM5BEGLN2TSHRPGRMEN1
SCHEMBL20074110 0.86 KDM5B (0.48) KDM5BEGLN2TSHRPGRCYP1A2
SCHEMBL20074112 0.86 TSHR (0.39) KDM5BTSHR
SCHEMBL20074303 0.85 CCNB2 (0.47) KDM5BEGLN2TSHRMEN1HPGD
SCHEMBL20074230 0.85 KDM5B (0.57) KDM5BTSHRMEN1HPGDKMT2A
SCHEMBL20074277 0.85 KDM5B (0.42) KDM5BEGLN2TSHRMEN1HPGD
SCHEMBL21681717 0.84 KDM5B (0.50) KDM5BEGLN2TSHR
SCHEMBL21721688 0.84 KDM5B (0.52) KDM5BTSHRCHEK1
SCHEMBL21681725 0.83 KDM5B (0.51) KDM5BEGLN2TSHRPGR
SCHEMBL20074315 0.83 KDM5B (0.51) KDM5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 2/4885EGLN2 600/4885TSHR 4342/4885
US-10975084-B2 KDM5 inhibitors KDM5A, KDM5B, KDM5C KDM5B 2/4885EGLN2 600/4885TSHR 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.