SCHEMBL6403980

SCHEMBL6403980

O=C(NCc1cc(CCl)no1)c1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
HPGD P15428 2/20 0.55
POLB P06746 2/20 0.55
MAPT P10636 1/20 0.55
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
RAB9A P51151 4/20 0.44
ALDH1A1 P00352 4/20 0.44
GLA P06280 1/20 0.44
ATM Q13315 1/20 0.44
GAA P10253 1/20 0.43
ALOX12 P18054 1/20 0.43
NPC1 O15118 4/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL6402261 0.86 HPGD (0.53) SMN1; SMN2HPGDPOLBRAB9AALDH1A1
SCHEMBL6410595 0.85 HPGD (0.51) SMN1; SMN2HPGDMAPTRAB9AALDH1A1
SCHEMBL6404892 0.85 EPHX2 (0.37) SMN1; SMN2HPGDPOLBMAPTRAB9A
SCHEMBL6403795 0.84 SMN1; SMN2 (0.39) SMN1; SMN2HPGDPOLBMAPTRAB9A
SCHEMBL6407810 0.83 HPGD (0.57) HPGDPOLBMAPTHDAC1HDAC7
SCHEMBL6407737 0.82 HDAC6 (0.49) SMN1; SMN2HPGDPOLBHDAC1ALDH1A1
SCHEMBL6401603 0.80 ALDH1A1 (0.40) SMN1; SMN2HPGDPOLBRAB9AALDH1A1
SCHEMBL6406614 0.80 NAMPT (0.48) SMN1; SMN2POLBRAB9ANPC1LMNA
SCHEMBL6406674 0.79 HPGD (0.58) SMN1; SMN2HPGDPOLBMAPTHDAC1
SCHEMBL6405928 0.79 MAPK1 (0.52) SMN1; SMN2HPGDPOLBMAPTRAB9A

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 SMN1; SMN2 4458/4885HPGD 3244/4885POLB 3713/4885

“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.