SCHEMBL15067975

SCHEMBL15067975

NC(=O)c1cc2cnncc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 2/20 0.41
FLT3 P36888 2/20 0.36
CCNC P24863 2/20 0.36
CDK8 P49336 2/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
DAO P14920 1/20 0.35
HPGD P15428 1/20 0.35
SRD5A2 P31213 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GPR35 Q9HC97 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
MMP2 P08253 1/20 0.35
MMP13 P45452 1/20 0.35
CFD P00746 1/20 0.35
ABL1 P00519 1/20 0.34
PDGFRB P09619 1/20 0.34
KIT P10721 1/20 0.34

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
SCHEMBL30119068 1.00 MAP2K1 (0.41) MAP2K1FLT3CCNCCDK8KDM4E
SCHEMBL6501462 0.82 KDM4E (0.53) KDM4EMAPTDAOHPGDSRD5A2
SCHEMBL13271506 0.77 MAP2K1 (0.38) MAP2K1FLT3GPR35MMP2MMP13
SCHEMBL29721819 0.77 LCK (0.44) MAP2K1FLT3GPR35MMP2MMP13
SCHEMBL35211529 0.77 DAO (0.36) MAP2K1FLT3KDM4EDAOALDH1A1
SCHEMBL157702 0.77 HRH4 (0.56) MAP2K1CCNCCDK8DAOHRH4
SCHEMBL1884988 0.77 HRH4 (0.56) MAP2K1CCNCCDK8KDM4EDAO
SCHEMBL23212302 0.75 HRH4 (0.55) MAP2K1CCNCCDK8KDM4EDAO
SCHEMBL16608653 0.75 MAP2K1 (0.44) MAP2K1FLT3CCNCCDK8KDM4E
SCHEMBL13271409 0.75 CCNC (0.44) MAP2K1CCNCCDK8GPR35MMP2

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
WO-2013097052-A1 BROMODOMAIN INHIBITORS ABBOTT LABORATORIES (US) 2013-07-04 WO claimed
US-11364240-B2 Pyruvate kinase activators for use in treating blood disorders AGIOS PHARMACEUTICALS, INC. (US) 2022-06-21 US disclosed
WO-2013097052-A1 BROMODOMAIN INHIBITORS ABBOTT LABORATORIES (US) 2013-07-04 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 (1 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-11364240-B2 Pyruvate kinase activators for use in treating blood disorders PDK1, PDK2, PDK3 MAP2K1 1156/4885FLT3 383/4885CCNC 2751/4885

“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.