SCHEMBL30879040

SCHEMBL30879040

C=Cc1c(Cc2ccccc2)c(=O)n(C)c2nc(S(C)(=O)=O)ncc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.39
ALDH1A1 P00352 6/20 0.39
HPGD P15428 3/20 0.39
TLR7 Q9NYK1 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CYP1A2 P05177 5/20 0.35
CYP3A4 P08684 4/20 0.35
CYP2C9 P11712 4/20 0.35
CYP2C19 P33261 4/20 0.35
TSHR P16473 3/20 0.35
HSD17B10 Q99714 4/20 0.35
CASP1 P29466 3/20 0.35
CASP7 P55210 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
CYP2D6 P10635 2/20 0.35
USP2 O75604 1/20 0.35
TP53 P04637 1/20 0.35
GLA P06280 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 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
SCHEMBL30878960 0.83 ALDH1A1 (0.39) KDM4EALDH1A1HPGDRXFP1CYP1A2
SCHEMBL30879101 0.81 CYP1A2 (0.39) KDM4EALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL30879276 0.77 ALDH1A1 (0.34) KDM4EALDH1A1HPGDTLR7RXFP1
SCHEMBL30878989 0.75 WEE1 (0.48) ALDH1A1HPGDTP53MEN1KMT2A
SCHEMBL14039077 0.75 FGFR1 (0.41) KDM4EALDH1A1TLR7RXFP1CYP1A2
SCHEMBL30878669 0.75 RIPK2 (0.41) ABL1SRC
SCHEMBL30878469 0.72 CCNT1 (0.46) CYP1A2CYP3A4CYP2C9CYP2C19HSD17B10
SCHEMBL14004183 0.71 CTSS (0.41) TLR7RXFP1SMN1; SMN2TP53ABL1
SCHEMBL20563978 0.66 ABL1 (0.52) ABL1SRC
SCHEMBL30837130 0.66 ABL1 (0.52) ABL1SRC

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-4612148-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE AND 7-AMINO-1-PYRIMIDO[4,5-D]PYRIMIDIN-2(1 H)-ONE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER Cancer Research Technology Limited (GB) 2025-09-10 EP disclosed
WO-2024094963-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE AND 7-AMINO-1-PYRIMIDO[4,5-D]PYRIMIDIN-2(1 H)-ONE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-05-10 WO disclosed