SCHEMBL6404426

SCHEMBL6404426

CCCc1cc(CNC(=O)c2ccc(Br)cc2)on1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
RAB9A P51151 5/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 5/20 0.45
HSP90AA1 P07900 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HPGD P15428 2/20 0.45
LMNA P02545 1/20 0.45
CCNA2 P20248 1/20 0.44
CDK2 P24941 1/20 0.44

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
SCHEMBL6401580 0.88 POLB (0.49) POLBCTDSP1RAB9AMEN1KMT2A
SCHEMBL6404133 0.85 KMT2A (0.52) POLBRAB9AMEN1KMT2ATDP1
SCHEMBL6405202 0.85 HSP90AA1 (0.47) POLBRAB9AMEN1KMT2ATDP1
SCHEMBL6403020 0.84 NPC1 (0.52) POLBRAB9AMEN1KMT2ATDP1
SCHEMBL6404085 0.81 KMT2A (0.48) POLBCTDSP1RAB9AMEN1KMT2A
SCHEMBL6404298 0.79 KMT2A (0.50) POLBRAB9AMEN1KMT2ATDP1
SCHEMBL6402461 0.78 PPARA (0.49) POLBRAB9AMEN1KMT2ATDP1
SCHEMBL6403892 0.75 LMNA (0.49) RAB9AMEN1KMT2ATDP1CYP1A2
SCHEMBL6405966 0.75 POLB (0.55) POLBRAB9AMEN1KMT2ATDP1
SCHEMBL6410547 0.75 NPC1 (0.55) POLBRAB9AMEN1KMT2ATDP1

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
US-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide SDS BIOTECH K.K. (JP) 2005-08-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide AHR, ERG28, CYP1A2 POLB 3713/4885CTDSP1 3364/4885RAB9A 4044/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.