SCHEMBL5815535

SCHEMBL5815535

Cc1ccc(NC(=O)C2CCNC2)cc1C(=O)Nc1cnc(N)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.56
CYP2C9 P11712 3/20 0.56
BTK Q06187 6/20 0.53
MAPK14 Q16539 2/20 0.45
JAK2 O60674 1/20 0.45
CSF1R P07333 1/20 0.45
PDGFRB P09619 1/20 0.45
FGFR1 P11362 1/20 0.45
EPHB4 P54760 1/20 0.45
PTK2 Q05397 1/20 0.45
ULK1 O75385 2/20 0.45
KIT P10721 2/20 0.42
MALT1 Q9UDY8 1/20 0.42
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 1/20 0.41
PTBP1 P26599 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BLK P51451 2/20 0.41

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
SCHEMBL3933265 0.79 BRAF (0.61) BRAFCYP2C9BTKMAPK14JAK2
SCHEMBL2943886 0.76 BTK (0.76) BTKMAPK14KITBLKLCK
SCHEMBL2946275 0.74 BTK (0.70) BTKMAPK14KITBLKLCK
SCHEMBL2948804 0.74 BTK (0.68) BTKMAPK14KITBLKLCK
SCHEMBL1537904 0.72 ULK1 (0.53) ULK1LMNAGAASMN1; SMN2
SCHEMBL3932501 0.72 BRAF (1.00) BRAFCYP2C9BTKMAPK14JAK2
SCHEMBL3934918 0.72 CYP2C9 (0.56) BRAFCYP2C9LMNATP53GAA
SCHEMBL29458485 0.70 MALT1 (0.58) MALT1LMNAGAASMN1; SMN2
SCHEMBL22644321 0.70 MALT1 (0.58) MALT1LMNAGAASMN1; SMN2
SCHEMBL3931460 0.70 BRAF (0.71) BRAFCYP2C9BTKMAPK14JAK2

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-2006067445-A2 CSF-1R KINASE INHIBITORS ASTRAZENECA AB (SE) 2006-06-29 WO disclosed