SCHEMBL3383205

SCHEMBL3383205

CC(C)(C)c1cnc(NC(=O)Cc2ccc(B3OC(C)(C)C(C)(C)O3)cc2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 12/20 0.46
CDK2 P24941 12/20 0.46
CDK5 Q00535 8/20 0.46
CCNE2 O96020 4/20 0.45
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 2/20 0.43
NPC1 O15118 2/20 0.43
LMNA P02545 2/20 0.43
KMT2A Q03164 2/20 0.43
CDK1 P06493 3/20 0.42
CDK4 P11802 3/20 0.42
CCNB1 P14635 3/20 0.42
CCND1 P24385 3/20 0.42
CCNT1 O60563 1/20 0.42
CCNA2 P20248 1/20 0.42
CDK7 P50613 1/20 0.42
CDK9 P50750 1/20 0.42
CCNH P51946 1/20 0.42

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
SCHEMBL3382498 0.84 ROCK1 (0.46) CCNE1CDK2CDK5CCNE2ALDH1A1
SCHEMBL3380812 0.82 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2RAB9AMEN1NPC1
SCHEMBL1257268 0.74 FLT3 (0.54) RAB9ANPC1
SCHEMBL1256126 0.73 ALDH1A1 (0.46) ALDH1A1KMT2ADGAT1
SCHEMBL3382233 0.72 RET (0.50)
SCHEMBL30690785 0.72 LIPG (0.53)
SCHEMBL6862380 0.72 EPHX2 (0.58) ALDH1A1SMN1; SMN2RAB9AMEN1NPC1
SCHEMBL19349384 0.70 CXCR2 (0.43) ALDH1A1SMN1; SMN2DGAT1
SCHEMBL15416384 0.70 GAA (0.64) ALDH1A1SMN1; SMN2MEN1KMT2AHDAC1
SCHEMBL19261385 0.70 CCND3 (0.43) CCNE1CDK2CCNE2SMN1; SMN2RAB9A

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
EP-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed