SCHEMBL25604155

SCHEMBL25604155

CSc1cnc(C(F)(F)F)s1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
CDK5 Q00535 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FFAR2 O15552 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL128024 0.71 NOS1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL1995649 0.71 SLC6A3 (0.31)
SCHEMBL18071029 0.69 ALDH1A1 (0.44) MEN1KMT2AKDM4EALDH1A1
SCHEMBL31078390 0.69 ALDH1A1 (0.34) FFAR2ALDH1A1
SCHEMBL12206091 0.69
SCHEMBL16432464 0.69
SCHEMBL18179469 0.68 ALDH1A1 (0.31) ALDH1A1
SCHEMBL31206756 0.67 CA12 (0.46) MEN1KMT2AALDH1A1
SCHEMBL25165495 0.67 ALDH1A1 (0.33) ALDH1A1
SCHEMBL2470516 0.67

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
WO-2023108108-A1 RAF KINASE INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC (US) 2023-06-15 WO disclosed
WO-2023108103-A1 RAF KINASE INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC (US) 2023-06-15 WO disclosed