SCHEMBL12764151

SCHEMBL12764151

C#Cc1c[nH]c2ncc(-c3ccsc3)cc12

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 3/20 0.57
AXL P30530 3/20 0.57
CCNT1 O60563 1/20 0.53
CCNA2 P20248 1/20 0.53
CDK2 P24941 1/20 0.53
CDK9 P50750 1/20 0.53
AAK1 Q2M2I8 2/20 0.48
CYP2A6 P11509 2/20 0.47
PDGFRB P09619 6/20 0.43
PDGFRA P16234 6/20 0.43
LRRK2 Q5S007 1/20 0.42
MAPK1 P28482 1/20 0.42
TNIK Q9UKE5 1/20 0.40
KDR P35968 1/20 0.40
GSK3B P49841 1/20 0.40

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
SCHEMBL8258473 0.86 CDK8 (0.57) CDK8AXLCCNT1CCNA2CDK2
SCHEMBL12764154 0.77 CDK8 (0.56) CDK8AXLAAK1PDGFRBPDGFRA
SCHEMBL12764150 0.76 CDK8 (0.57) CDK8AXLCCNT1CCNA2CDK2
SCHEMBL8249652 0.76 MAPK8 (0.60) CDK8AXLAAK1TNIKGSK3B
SCHEMBL15799266 0.74 CDK8 (0.70) CDK8AXLCCNT1CCNA2CDK2
SCHEMBL15779522 0.74 MAP3K11 (0.58) AAK1
SCHEMBL3761982 0.74 DYRK1A (0.75) CDK8AXLCCNT1CCNA2CDK2
SCHEMBL12764153 0.72 AXL (0.46) CDK8AXLAAK1TNIKGSK3B
SCHEMBL8321343 0.72 CDK8 (0.70) CDK8AXLCCNT1CCNA2CDK2
SCHEMBL15799643 0.72 CDK8 (0.70) CDK8AXLCCNT1CCNA2CDK2

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-20150313881-A1 Therapeutic Methods for Type I Diabetes UNIVERSITY OF MASSACHUSETTS 2015-11-05 US disclosed
US-7897572-B1 Theraputic methods for type I diabetes UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL (US) 2011-03-01 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-20150313881-A1 Therapeutic Methods for Type I Diabetes MAPK9, IAPP, RNASE1 CDK8 1731/4885AXL 2467/4885CCNT1 3711/4885

“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.