SCHEMBL21178486

SCHEMBL21178486

Cn1nncc1-c1ccc2c(Br)c[nH]c2n1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.36
IDH1 O75874 1/20 0.31
MASTL Q96GX5 2/20 0.30
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30

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
SCHEMBL21178859 0.74 BRD4 (0.41) AXLIDH1
SCHEMBL21179056 0.69 AXL (0.36) AXL
SCHEMBL29605205 0.67 ADORA2A (0.50) AXL
SCHEMBL14635390 0.67 ADORA2A (0.50) AXL
SCHEMBL28634050 0.66 AXL (0.52) AXLCDK2
SCHEMBL21178314 0.65 ACHE (0.40) AXL
SCHEMBL21178708 0.65 L3MBTL1 (0.37) AXL
SCHEMBL21178483 0.65 AXL (0.37) AXL
SCHEMBL21188515 0.65 AXL (0.37) AXLCDK2
SCHEMBL21178901 0.64 AXL (0.36) AXLCDK2

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
EP-3740207-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) Syros Pharmaceuticals, Inc. (US) 2020-11-25 EP disclosed
WO-2019143719-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed
WO-2019143719-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed