SCHEMBL15980684

SCHEMBL15980684

Cc1nc(C(C)C)ccc1-c1ccc(-c2nccn2C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 1/20 0.43
CCNC P24863 3/20 0.39
CDK8 P49336 3/20 0.39
EDNRA P25101 1/20 0.38
HDAC4 P56524 2/20 0.36
BRD4 O60885 1/20 0.35
NMT1 P30419 1/20 0.33
GRM5 P41594 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
LRRK2 Q5S007 2/20 0.32
KDM4E B2RXH2 2/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PDE10A Q9Y233 1/20 0.31
NPC1 O15118 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL15984792 0.82 CCNC (0.41) KDM5BCCNCCDK8EDNRAHDAC4
SCHEMBL15980679 0.75 PDE3B (0.40)
SCHEMBL16606148 0.75 HDAC4 (0.47) KDM5BCCNCCDK8EDNRAHDAC4
SCHEMBL15980670 0.74 KDM5B (0.38) KDM5B
SCHEMBL15980657 0.73 PSMB5 (0.42) KDM4EHSD17B10L3MBTL1ADORA2AADORA1
SCHEMBL15980685 0.71 LTA4H (0.40) CCNCCDK8EDNRAHDAC4ADORA2A
SCHEMBL15980662 0.71 KDM5B (0.36) KDM5BHSD17B10
SCHEMBL10194263 0.70 KDM4E (0.51) KDM5BCCNCCDK8EDNRAHDAC4
SCHEMBL15980668 0.70 KDM4E (0.44) KDM5BKDM4ENPC1RAB9A
SCHEMBL15980686 0.69 MAPK14 (0.44) BRD4KDM4EHSD17B10ADORA2A

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-9216173-B2 2-Pyridyl carboxamide-containing spleen tyrosine kinase (SYK) inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-22 US disclosed
US-20140243336-A1 2-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors MERCK SHARP & DOHME LLC 2014-08-28 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-20140243336-A1 2-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors SYK, BTK, LCK KDM5B 313/4885CCNC 2545/4885CDK8 863/4885

“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.