SCHEMBL5538584

SCHEMBL5538584

COc1[nH]cc(-c2cc3c(Cl)ccnc3[nH]2)c1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 9/20 0.40
CDC7 O00311 1/20 0.40
PIM1 P11309 1/20 0.40
CCNT1 O60563 8/20 0.39
BRD4 O60885 3/20 0.38
AXL P30530 1/20 0.37
PRKCI P41743 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
CHUK O15111 1/20 0.36
INSR P06213 1/20 0.36
MAPK8 P45983 1/20 0.36
CAMKK2 Q96RR4 1/20 0.36
MAPK14 Q16539 1/20 0.35
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35

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
SCHEMBL1779702 0.77 MAP3K14 (0.52) CDK9CCNT1DYRK1BGSK3AGSK3B
SCHEMBL2990264 0.76 EGFR (0.38) CDK9CDC7PIM1CCNT1BRD4
SCHEMBL2447762 0.75 CCNB2 (0.60) CDK9CDC7PIM1CCNT1BRD4
SCHEMBL24615544 0.71 CDK9 (0.43) CDK9CDC7PIM1CCNT1AXL
SCHEMBL2444894 0.69 CCNB2 (0.64) CDK9CDC7PIM1CHUKMAPK14
SCHEMBL1748886 0.69 IGF1R (0.67) CDK9CDC7PIM1CCNT1DYRK1B
SCHEMBL31240606 0.68 EGFR (0.54) CDK9CDC7PIM1CCNT1CHUK
SCHEMBL1779401 0.68 IGF1R (0.71) CDK9CDC7PIM1CCNT1DYRK1B
SCHEMBL3415638 0.68 CDK9 (0.48) CDK9CDC7PIM1CCNT1AXL
SCHEMBL2984402 0.68 IGF1R (0.51) CDK9CDC7PIM1CCNT1CHUK

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
EP-1799691-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2007-06-27 EP claimed
WO-2006037875-A1 NOVEL BIS-AZAINDOLE DERIVATIVES, PREPARATION AND PHARMACEUTICAL USE THEREOF AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2006-04-13 WO claimed