SCHEMBL6403386

SCHEMBL6403386

Cc1ccc(-c2cc(CNC(=O)C3CCC3)on2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.53
SMN1; SMN2 Q16637 5/20 0.51
CYP1A2 P05177 1/20 0.51
LMNA P02545 2/20 0.50
ALDH1A1 P00352 5/20 0.49
HTT P42858 3/20 0.49
JAK2 O60674 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 3/20 0.47
EPHX2 P34913 1/20 0.47
HPGD P15428 2/20 0.45
RAB9A P51151 1/20 0.43
USP2 O75604 2/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL6407634 0.98 POLB (0.53) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL6404231 0.96 POLB (0.52) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263069 0.86 POLB (0.51) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263057 0.86 POLB (0.66) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263024 0.86 EPHX2 (0.60) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263070 0.85 ALDH1A1 (0.51) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263020 0.85 SMN1; SMN2 (0.69) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263258 0.83 HDAC1 (0.53) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263028 0.83 POLB (0.47) POLBSMN1; SMN2CYP1A2LMNAALDH1A1
SCHEMBL19263282 0.83 POLB (0.41) POLBSMN1; SMN2CYP1A2LMNAALDH1A1

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 3713/4885SMN1; 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.