SCHEMBL8048802

SCHEMBL8048802

NC(=O)c1c(N)cc(Br)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NMT1 P30419 1/20 0.35
POLB P06746 1/20 0.35
PARP1 P09874 1/20 0.34
PLAU P00749 2/20 0.33
SLC9A1 P19634 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
GPR35 Q9HC97 2/20 0.33
CDC7 O00311 1/20 0.33
EEF2K O00418 1/20 0.33
PLK4 O00444 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
ROCK2 O75116 1/20 0.33
RPS6KA5 O75582 1/20 0.33
PRKD3 O94806 1/20 0.33
MAP4K4 O95819 1/20 0.33
INSR P06213 1/20 0.33
CDK1 P06493 1/20 0.33
CSF1R P07333 1/20 0.33

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
SCHEMBL27623475 0.87 NMT1 (0.40) NMT1POLBPARP1PLAUKDM4E
SCHEMBL31057404 0.84 KDM4E (0.41) NMT1POLBKDM4EGLAGPR35
SCHEMBL7781021 0.84 KDM4E (0.41) NMT1POLBKDM4EGLAGPR35
SCHEMBL366927 0.79 CYP3A4 (0.44) POLBPARP1SLC9A1KDM4EGLA
SCHEMBL24619347 0.78 DGAT1 (0.47) NMT1POLBPARP1PLAUCASP1
SCHEMBL31204508 0.78 POLB (0.50) NMT1POLBPARP1TSHRHTT
SCHEMBL29925464 0.78 DGAT1 (0.47) NMT1POLBPARP1PLAUCASP1
SCHEMBL3713227 0.78 POLB (0.50) NMT1POLBPARP1TSHRHTT
SCHEMBL25280258 0.78 WDR5 (0.41)
SCHEMBL31057270 0.78 GAA (0.45) KDM4EGLACASP1TSHRLMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111253397-B MNK inhibitors 上海迪诺医药科技有限公司 2023-11-14 CN disclosed
CN-111253397-A MNK inhibitors 上海迪诺医药科技有限公司 2020-06-09 CN disclosed
EP-0789020-B1 Process for producing dioxoquinazolines SUMITOMO CHEMICAL CO (JP) 2000-04-12 EP disclosed
US-5780628-A Process for producing dioxoquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed
EP-0789020-A1 Process for producing dioxoquinazolines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-13 EP disclosed