SCHEMBL30116111

SCHEMBL30116111

CC(C)(Cc1ccc(-c2cnc3[nH]cc(Br)c3c2)cn1)OC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 7/20 0.41
MAP3K11 Q16584 5/20 0.41
SGK1 O00141 2/20 0.39
CDK8 P49336 1/20 0.39
AXL P30530 2/20 0.39
KIT P10721 1/20 0.39
CLK1 P49759 1/20 0.39
DYRK1A Q13627 1/20 0.39
DYRK2 Q92630 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
ABL1 P00519 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAP4K1 Q92918 1/20 0.38
CAMKK2 Q96RR4 1/20 0.38
STK17B O94768 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
SCHEMBL4154787 0.72 MAP3K11 (0.51) MAP3K11SGK1CDK8AXLCLK1
SCHEMBL27851403 0.70 MAPT (0.36) CYP3A4
SCHEMBL27850881 0.70 ESR1 (0.39) CYP3A4
SCHEMBL27603372 0.69 CYP3A4 (0.35) CYP3A4
SCHEMBL4154994 0.69 AXL (0.45) MAP3K11SGK1CDK8AXLCLK1
SCHEMBL27697912 0.69 GABRG2 (0.32) CYP3A4
SCHEMBL28791680 0.68 CYP3A4 (0.36) CYP3A4
SCHEMBL27588055 0.67 CYP4F2 (0.36) CYP3A4
SCHEMBL5549486 0.66 CDK8 (0.42) AAK1SGK1CDK8AXLCYP3A4
SCHEMBL4159593 0.65 AXL (0.69) MAP3K11SGK1CDK8AXLKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548867-B2 Amido compounds as AhR modulators IDEA YA BIOSCIENCES, INC. (US) 2023-01-10 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-11548867-B2 Amido compounds as AhR modulators AHR, ARNT, RXRB AAK1 2874/4885MAP3K11 2746/4885SGK1 4593/4885

“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.