SCHEMBL31061059

SCHEMBL31061059

COc1cc(-c2cnc3[nH]cc(-c4ccc5[nH]ccc5c4)c3c2)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP3K11 Q16584 13/20 1.00
LRRK2 Q5S007 3/20 1.00
KIT P10721 4/20 0.74
DYRK1A Q13627 3/20 0.66
CYP3A4 P08684 2/20 0.66
CYP2D6 P10635 2/20 0.66
DYRK2 Q92630 2/20 0.66
DYRK1B Q9Y463 2/20 0.66
CYP2C9 P11712 1/20 0.65
CLK1 P49759 1/20 0.63
BRD4 O60885 1/20 0.62

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
SCHEMBL722870 1.00 MAP3K11 (1.00) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL720862 0.90 MAP3K11 (1.00) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL724259 0.88 MAP3K11 (0.83) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL27841169 0.85 MAP3K11 (0.83) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL723789 0.85 MAP3K11 (1.00) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL721794 0.85 MAP3K11 (1.00) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL12763559 0.83 MAP3K11 (0.76) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL720152 0.82 MAP3K11 (0.70) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL18136450 0.82 MAP3K11 (0.72) MAP3K11LRRK2KITDYRK1ACYP3A4
SCHEMBL722517 0.82 MAP3K11 (0.79) MAP3K11LRRK2KITDYRK1ACYP3A4

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
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed