SCHEMBL21392462

SCHEMBL21392462

CCn1ccc(NC2CC2)nc1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
HPGD P15428 1/20 0.52
MAPT P10636 1/20 0.40
PDE7A Q13946 6/20 0.39
MALT1 Q9UDY8 1/20 0.39
PDE4B Q07343 3/20 0.36
MEN1 O00255 1/20 0.36
MERTK Q12866 1/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CHEK1 O14757 1/20 0.35
FLT3 P36888 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CCND2 P30279 1/20 0.35
CCND3 P30281 1/20 0.35
FAAH O00519 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
SCHEMBL15034719 0.79 KMT2A (0.43) KMT2AHPGDMALT1MEN1KDM4E
SCHEMBL14639242 0.77 MAPT (0.47) KMT2AHPGDMAPTPDE7AKDM4E
SCHEMBL9806949 0.72 MAPT (0.43) KMT2AHPGDMAPTPOLBSMN1; SMN2
SCHEMBL2865257 0.69 KMT2A (0.40) KMT2AMAPTMEN1KDM4EPOLB
SCHEMBL22672647 0.68 MEN1 (0.54) KMT2AMAPTMEN1KDM4EPOLB
SCHEMBL10697070 0.68 KDM4E (0.51) KMT2AHPGDMAPTMEN1KDM4E
SCHEMBL1892698 0.67 FGFR1 (0.44) MAPT
SCHEMBL14872357 0.67 MAPT (0.35) KMT2AHPGDMAPTPDE4BKDM4E
SCHEMBL11249598 0.67 MAPT (0.35) KMT2AMAPTKDM4EMAPK1
SCHEMBL22249241 0.67 MAPT (0.44) KMT2AHPGDMAPTKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190290670-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS IDENIX PHARMACEUTICALS LLC (US) 2019-09-26 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 (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-20190290670-A1 METHODS AND COMPOSITIONS FOR TREATING HEPATITIS C VIRUS HAVCR2, HCCS, PYGL KMT2A 3715/4885HPGD 1756/4885MAPT 3313/4885

“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.