SCHEMBL17442986

SCHEMBL17442986

Fc1nc(NCc2ccc(Cl)cc2)c2nc[nH]c2n1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.45
CCNE2 O96020 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK2 P24941 1/20 0.44
STAT3 P40763 1/20 0.43
LRRK2 Q5S007 1/20 0.42
CDK5 Q00535 1/20 0.40
CDK5R1 Q15078 1/20 0.40
EGFR P00533 1/20 0.40
VNN1 O95497 1/20 0.40
GRM4 Q14833 1/20 0.39
FABP4 P15090 1/20 0.39
APP P05067 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL17443005 0.89 MAP2K4 (0.43) APPKDM4E
SCHEMBL5997041 0.86 CDK1 (0.48) CDK2EGFRAPP
SCHEMBL5828183 0.86 CCNE2 (0.52) HSD17B10CCNE2CCNE1CDK2STAT3
SCHEMBL3304345 0.85 KCNH3 (0.39) HSD17B10CDK2EGFRKDM4E
SCHEMBL3302062 0.85 TMIGD3 (0.56) LRRK2CDK5EGFRGRM4FABP4
SCHEMBL16145902 0.84 LRRK2 (0.48) HSD17B10CCNE2CCNE1CDK2STAT3
SCHEMBL16145987 0.84 APP (0.53) HSD17B10CCNE2CCNE1CDK2STAT3
SCHEMBL16146439 0.84 STAT3 (0.43) HSD17B10CCNE2CCNE1CDK2STAT3
SCHEMBL26784724 0.81 CCNE2 (0.44) CCNE2CCNE1CDK2APP
SCHEMBL3302949 0.81 PDE10A (0.42) CDK2VNN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10519160-B2 Imaging agents for neural flux THE GENERAL HOSPITAL CORPORATION (US) 2019-12-31 US disclosed
US-10519160-B2 Imaging agents for neural flux THE GENERAL HOSPITAL CORPORATION (US) 2019-12-31 US disclosed
US-20180258090-A1 IMAGING AGENTS FOR NEURAL FLUX UNITED STATES DEPARTMENT OF ENERGY 2018-09-13 US disclosed
WO-2016011394-A1 IMAGING AGENTS FOR NEURAL FLUX THE GENERAL HOSPITAL CORPORATION (US) 2016-01-21 WO disclosed
WO-2016011394-A1 IMAGING AGENTS FOR NEURAL FLUX THE GENERAL HOSPITAL CORPORATION (US) 2016-01-21 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-10519160-B2 Imaging agents for neural flux SLC18A2, SLC18A3, PMP22 HSD17B10 3411/4885CCNE2 4272/4885CCNE1 3918/4885
US-20180258090-A1 IMAGING AGENTS FOR NEURAL FLUX SLC18A2, SLC18A3, PMP22 HSD17B10 3411/4885CCNE2 4272/4885CCNE1 3918/4885

“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.