SCHEMBL6407566

SCHEMBL6407566

CC(C)Cc1cc(CNC(=O)O)on1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.46
NPC1 O15118 6/20 0.46
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
EPHX2 P34913 3/20 0.43
MAPK1 P28482 1/20 0.43
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
HPGD P15428 1/20 0.40
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
VHL P40337 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL18031837 0.88 POLB (0.50) RAB9ANPC1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL16907558 0.87 RAB9A (0.45) RAB9ANPC1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL6404261 0.83 TDP1 (0.50) RAB9ANPC1ALDH1A1SMN1; SMN2MAPK1
SCHEMBL6408026 0.82 NPC1 (0.50) RAB9ANPC1ALDH1A1SMN1; SMN2MAPK1
SCHEMBL4013192 0.81 EPHX2 (0.44) RAB9ANPC1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL6402461 0.80 PPARA (0.49) RAB9ANPC1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL5297276 0.80 VHL (0.42) RAB9ANPC1ALDH1A1SMN1; SMN2MAPK1
SCHEMBL6404146 0.80 EPHX2 (0.43) RAB9ANPC1ALDH1A1SMN1; SMN2EPHX2
SCHEMBL6403020 0.79 NPC1 (0.52) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL6405222 0.79 SMN1; SMN2 (0.59) RAB9ANPC1ALDH1A1SMN1; SMN2EPHX2

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 RAB9A 4044/4885NPC1 1915/4885ALDH1A1 1486/4885

“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.