SCHEMBL22736470

SCHEMBL22736470

CCCS(=O)(=O)NC1CCN(C(=O)CC2C=C(c3ccnc4[nH]cnc34)C=NCC2)C1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 1/20 0.34
▸ JAK2 O60674 3/20 0.32
▸ JAK3 P52333 3/20 0.32
▸ CCNT1 O60563 2/20 0.31
▸ CDK9 P50750 2/20 0.31
▸ CCR8 P51685 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
SCHEMBL22735995 0.77 CCNT1 (0.34) CCNT1CDK9
SCHEMBL29480630 0.74 FGFR4 (0.35) FGFR4JAK2JAK3
SCHEMBL22736003 0.64 — —
SCHEMBL22735782 0.62 EPHX2 (0.40) FGFR4CCR8
SCHEMBL30008783 0.55 JAK2 (0.64) JAK2JAK3
SCHEMBL16078083 0.54 PSEN1 (0.38) FGFR4JAK2JAK3
SCHEMBL28969004 0.54 ITGB3 (0.43) —
SCHEMBL28969007 0.54 ITGB3 (0.43) —
SCHEMBL30009346 0.54 JAK1 (0.65) JAK2JAK3CCNT1CDK9
SCHEMBL16072929 0.54 PSEN1 (0.38) FGFR4JAK2JAK3

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
WO-2020240586-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2020-12-03 — — WO disclosed
Send feedback