SCHEMBL27698212

SCHEMBL27698212

NC(=O)c1cc(-c2ccsc2)cc2cn[nH]c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 4/20 0.50
▸ BTK Q06187 2/20 0.50
▸ PLK4 O00444 1/20 0.50
▸ AURKA O14965 1/20 0.50
▸ DAPK3 O43293 1/20 0.50
▸ MAP4K4 O95819 1/20 0.50
▸ CSF1R P07333 1/20 0.50
▸ RET P07949 1/20 0.50
▸ FGFR1 P11362 1/20 0.50
▸ PDGFRA P16234 1/20 0.50
▸ LTK P29376 1/20 0.50
▸ KDR P35968 1/20 0.50
▸ MAP2K2 P36507 1/20 0.50
▸ FLT3 P36888 1/20 0.50
▸ CSNK1A1 P48729 1/20 0.50
▸ PRKX P51817 1/20 0.50
▸ CDK5 Q00535 1/20 0.50
▸ MAP2K1 Q02750 1/20 0.50
▸ MST1R Q04912 1/20 0.50
▸ PTK2 Q05397 1/20 0.50

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
SCHEMBL27698209 0.81 IKBKB (0.61) CHEK1BTKPLK4AURKADAPK3
SCHEMBL27689999 0.78 IKBKB (0.66) BTKCHEK2CDC7IKBKBCHUK
SCHEMBL27698210 0.78 CHEK1 (0.52) CHEK1BTKPLK4AURKADAPK3
SCHEMBL1421939 0.72 BTK (0.58) CHEK1BTKPLK4AURKADAPK3
SCHEMBL23185496 0.71 BTK (0.57) CHEK1BTKPLK4AURKADAPK3
SCHEMBL29232675 0.71 BTK (0.57) CHEK1BTKPLK4AURKADAPK3
SCHEMBL16258828 0.71 BTK (0.57) CHEK1BTKPLK4AURKADAPK3
SCHEMBL20487617 0.71 BTK (0.57) CHEK1BTKPLK4AURKADAPK3
SCHEMBL30567530 0.69 PLK4 (0.42) CHEK1BTKPLK4AURKADAPK3
SCHEMBL28494095 0.69 ADORA2A (0.50) CHEK1BTKPLK4AURKADAPK3

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
CN-101005836-A Novel indazole carboxamides and their use SMITHKLINE BEECHAM CORP (US) 2007-07-25 — — CN disclosed
Send feedback