SCHEMBL84406

SCHEMBL84406

CC(C)c1cnc2[nH]cc(Br)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.43
DYRK1A Q13627 3/20 0.36
PLK4 O00444 1/20 0.36
AURKA O14965 1/20 0.36
JAK2 O60674 1/20 0.36
ROCK2 O75116 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
PRKCG P05129 1/20 0.36
INSR P06213 1/20 0.36
CDK1 P06493 1/20 0.36
FES P07332 1/20 0.36
IGF1R P08069 1/20 0.36
ROS1 P08922 1/20 0.36
FGFR1 P11362 1/20 0.36
PHKG2 P15735 1/20 0.36
FER P16591 1/20 0.36
FLT1 P17948 1/20 0.36
CDK2 P24941 1/20 0.36
MARK3 P27448 1/20 0.36

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
SCHEMBL30731275 0.87 AXL (0.41) AXLDYRK1APLK4AURKAJAK2
SCHEMBL22554210 0.87 AXL (0.41) AXLDYRK1APLK4AURKAJAK2
SCHEMBL13976070 0.81 PRMT5 (0.43) AXLDYRK1APLK4AURKAJAK2
SCHEMBL84584 0.81 MET (0.42) AXLITKPRMT5WDR77
SCHEMBL19105605 0.79 MAP3K12 (0.41) AXLDYRK1AJAK2ROCK2PRKD3
SCHEMBL84420 0.79 MAP3K12 (0.41) JAK2ITKPRMT5WDR77
SCHEMBL18352451 0.77 MAP3K12 (0.35) AXLDYRK1ACLK1SGK1CDK8
SCHEMBL91446 0.77 AXL (0.47) AXLDYRK1APLK4AURKAJAK2
SCHEMBL24012829 0.76 PRMT5 (0.41) DYRK1ACLK1SGK1CAMKK2HASPIN
SCHEMBL13523638 0.76 MAP3K12 (0.47) PRMT5WDR77

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
WO-2021223736-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON PHARMACEUTICALS, LTD. (CN) 2021-11-11 WO disclosed
US-8129394-B2 Heteroaryl-substituted imidazole compounds and uses thereof NOVARTIS AG (CH) 2012-03-06 US disclosed
US-20100003246-A1 Novel heterocyclic compounds and uses therof NOVARTIS AG (CH) 2010-01-07 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-20100003246-A1 Novel heterocyclic compounds and uses therof BRAF, ARAF, KRAS AXL 135/4885DYRK1A 776/4885PLK4 846/4885

“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.