SCHEMBL9535007

SCHEMBL9535007

CCOC(=O)C(=O)c1ccc(-c2ccc3ccccc3c2)nc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
PDCD1 Q15116 2/20 0.43
CD274 Q9NZQ7 2/20 0.43
JAK2 O60674 1/20 0.43
JAK3 P52333 1/20 0.43
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 0.42
ALPL P05186 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ATM Q13315 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
CTRC Q99895 1/20 0.40
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40

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
SCHEMBL9536313 0.88 DHODH (0.42) MEN1KMT2APDCD1CD274SLC6A2
SCHEMBL20718975 0.85 CD274 (0.39) MEN1KMT2APDCD1CD274NPC1
SCHEMBL9534914 0.84 SLC6A2 (0.47) MEN1KMT2APDCD1CD274SLC6A2
SCHEMBL20719469 0.83 MEN1 (0.44) MEN1KMT2APDCD1CD274JAK2
SCHEMBL20719845 0.81 SLC6A2 (0.49) MEN1KMT2APDCD1CD274SLC6A2
SCHEMBL9538604 0.81 CD274 (0.45) MEN1KMT2APDCD1CD274KDM4E
SCHEMBL20719844 0.79 ALDH1A1 (0.53) MEN1KMT2APDCD1CD274JAK2
SCHEMBL9533834 0.79 ALDH1A1 (0.52) PDCD1CD274KDM4EALDH1A1HPGD
SCHEMBL9534377 0.78 MEN1 (0.42) MEN1KMT2ACD274JAK2JAK3
SCHEMBL9534841 0.77 MEN1 (0.41) MEN1KMT2ACD274JAK2JAK3

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-0532531-A1 PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-03-24 EP disclosed
WO-1991017987-A1 PHENOL AND PYRIDINOL DERIVATIVES AS PHARMACEUTICALS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1991-11-28 WO disclosed