SCHEMBL19901818

SCHEMBL19901818

Cc1cccc(Nc2nc(NC3CCCCC3N)ccc2C(=O)NC2CCCCCCC2)c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FER P16591 12/20 0.78
▸ SYK P43405 7/20 0.78
▸ MAPK1 P28482 3/20 0.62
▸ JAK2 O60674 2/20 0.62
▸ ROCK2 O75116 2/20 0.62
▸ MAP4K4 O95819 2/20 0.62
▸ HCK P08631 2/20 0.62
▸ ROS1 P08922 2/20 0.62
▸ PIM1 P11309 2/20 0.62
▸ PRKACA P17612 2/20 0.62
▸ MARK3 P27448 2/20 0.62
▸ LTK P29376 2/20 0.62
▸ CSNK1A1 P48729 2/20 0.62
▸ CLK2 P49760 2/20 0.62
▸ MAPK10 P53779 2/20 0.62
▸ MAP2K1 Q02750 2/20 0.62
▸ MAP3K10 Q02779 2/20 0.62
▸ PRKCQ Q04759 2/20 0.62
▸ PTK2 Q05397 2/20 0.62
▸ TYRO3 Q06418 2/20 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
SCHEMBL10250587 0.90 FER (0.82) FERSYKMAPK1JAK2ROCK2
SCHEMBL2713216 0.88 SYK (1.00) FERSYKMAPK1JAK2ROCK2
SCHEMBL2713511 0.88 SYK (1.00) FERSYKMAPK1JAK2ROCK2
SCHEMBL19901817 0.81 NPC1 (0.56) FERSYKMAPK1KCNH2MAPK3
SCHEMBL9103569 0.80 SYK (0.82) FERSYKMAPK1JAK2ROCK2
SCHEMBL2716733 0.80 SYK (0.82) FERSYKMAPK1JAK2ROCK2
SCHEMBL6154806 0.80 SYK (0.85) FERSYKMAPK1JAK2ROCK2
SCHEMBL6154803 0.80 SYK (0.85) FERSYKMAPK1JAK2ROCK2
SCHEMBL5027051 0.79 FER (0.71) FERSYKMAPK1JAK2ROCK2
SCHEMBL6158559 0.77 FER (1.00) FERSYKMAPK1JAK2ROCK2

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-9902688-B2 Benzamides and nicotinamides as Syk modulators PORTOLA PHARMACEUTICALS, INC. (US) 2018-02-27 — — US disclosed
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