SCHEMBL20074256

SCHEMBL20074256

CC(C)c1c(-c2cccc(N3CCOCC3)c2)[nH]c2ncnn2c1=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 3/20 0.55
KIF11 P52732 3/20 0.42
PIK3CD O00329 4/20 0.39
METAP2 P50579 1/20 0.39
LRRK2 Q5S007 1/20 0.39
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
KMO O15229 1/20 0.38
TLR9 Q9NR96 3/20 0.38
TLR8 Q9NR97 3/20 0.38
TLR7 Q9NYK1 3/20 0.38
LCK P06239 1/20 0.38
KDR P35968 1/20 0.38
STK17B O94768 1/20 0.37
KIT P10721 1/20 0.37

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
SCHEMBL31676990 1.00 KDM5B (0.55) KDM5BKIF11PIK3CDMETAP2LRRK2
SCHEMBL20074250 0.91 KDM5B (0.53) KDM5BKIF11PIK3CDTLR9TLR8
SCHEMBL31676991 0.91 KDM5B (0.53) KDM5BKIF11PIK3CDTLR9TLR8
SCHEMBL20074325 0.89 KDM5B (0.52) KDM5BKIF11TLR9TLR8TLR7
SCHEMBL20074112 0.82 TSHR (0.39) KDM5BPIK3CDBRD4CREBBPTLR9
SCHEMBL20074310 0.81 KDM5B (0.49) KDM5BKIF11TLR9TLR8TLR7
SCHEMBL20074117 0.81 KDM5B (0.55) KDM5BBRD4CREBBPTLR9TLR8
SCHEMBL20074314 0.81 KDM5B (0.55) KDM5BMETAP2
SCHEMBL31676984 0.81 KDM5B (0.55) KDM5BMETAP2
SCHEMBL20074255 0.80 KDM5B (0.50) KDM5BKIF11TLR9TLR8TLR7

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 3 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
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 2/4885KIF11 414/4885PIK3CD 1245/4885
US-10975084-B2 KDM5 inhibitors KDM5A, KDM5B, KDM5C KDM5B 2/4885KIF11 414/4885PIK3CD 1245/4885

“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.