SCHEMBL15976006

SCHEMBL15976006

COC(=O)c1cc(-c2ccc(OC)cc2)nc(-c2ccc(OCc3ccccc3)cc2)c1N=[N+]=[N-]

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 7/20 0.48
DHODH Q02127 2/20 0.47
MCL1 Q07820 4/20 0.45
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HDAC1 Q13547 1/20 0.41
PDE10A Q9Y233 1/20 0.41

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
SCHEMBL15800320 0.88 PLA2G2A (0.54) PLA2G2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL15976013 0.87 MCL1 (0.41) PLA2G2ADHODHMCL1SMN1; SMN2HDAC1
SCHEMBL15976007 0.86 PLA2G2A (0.50) PLA2G2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL15976003 0.85 PLA2G2A (0.50) PLA2G2ADHODHKDM4ESMN1; SMN2
SCHEMBL110393 0.84 DHODH (0.52) PLA2G2ADHODHMCL1KDM4EALDH1A1
SCHEMBL15800322 0.81 PLA2G2A (0.47) PLA2G2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL15976000 0.73 TACR3 (0.41) PLA2G2ADHODHKDM4EALDH1A1SMN1; SMN2
SCHEMBL15976429 0.72 PLA2G2A (0.57) PLA2G2ADHODHKDM4EALDH1A1SMN1; SMN2
SCHEMBL110395 0.72 PLA2G2A (0.69) PLA2G2ADHODHKDM4EALDH1A1SMN1; SMN2
SCHEMBL15976010 0.71 DHODH (0.41) PLA2G2ADHODHKDM4EALDH1A1SMN1; SMN2

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
US-8815840-B2 Carbazole and carboline kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-26 US disclosed
US-8815840-B2 Carbazole and carboline kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-26 US disclosed
US-20120058988-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-03-08 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-20120058988-A1 CARBAZOLE AND CARBOLINE KINASE INHIBITORS JAK2, JAK1, JAK3 PLA2G2A 4509/4885DHODH 3348/4885MCL1 36/4885

“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.