SCHEMBL6409982

SCHEMBL6409982

COCc1cc(CNC(=O)c2ccc(OC)cc2)on1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
SMN1; SMN2 Q16637 5/20 0.52
CYP1A2 P05177 1/20 0.52
MEN1 O00255 3/20 0.51
NPC1 O15118 7/20 0.50
RAB9A P51151 7/20 0.50
POLB P06746 2/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.49
KDM4E B2RXH2 1/20 0.49
HTT P42858 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.47
TP53 P04637 2/20 0.47
EPHX2 P34913 2/20 0.47
NR1H4 Q96RI1 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HPGD P15428 1/20 0.46

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
SCHEMBL6403186 0.92 KMT2A (0.53) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6404219 0.91 ALDH1A1 (0.58) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6410555 0.90 SMN1; SMN2 (0.52) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6403585 0.88 SMN1; SMN2 (0.55) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6405118 0.88 PLK1 (0.50) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6407567 0.88 KMT2A (0.55) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6405167 0.88 RAB9A (0.50) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6405537 0.88 NPC1 (0.54) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6401570 0.88 KMT2A (0.50) KMT2ASMN1; SMN2CYP1A2MEN1NPC1
SCHEMBL6404133 0.87 KMT2A (0.52) KMT2ASMN1; SMN2CYP1A2MEN1NPC1

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 KMT2A 986/4885SMN1; SMN2 4458/4885CYP1A2 3/4885

“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.