SCHEMBL4024862

SCHEMBL4024862

CCCCCc1cc(C(C)=O)no1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.56
SMN1; SMN2 Q16637 6/20 0.49
RAB9A P51151 9/20 0.48
NPC1 O15118 7/20 0.48
MAPK1 P28482 2/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
S1PR1 P21453 2/20 0.43
S1PR3 Q99500 2/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
XBP1 P17861 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RIPK1 Q13546 1/20 0.43
GPR84 Q9NQS5 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
MAPT P10636 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
SCHEMBL4033814 0.98 PPARA (0.58) PPARASMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL4030288 0.95 SMN1; SMN2 (0.50) PPARASMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL4033216 0.87 SMN1; SMN2 (0.60) SMN1; SMN2RAB9ANPC1MAPK1ALDH1A1
SCHEMBL4016809 0.86 PPARA (0.60) PPARASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL27275588 0.85 PPARA (0.55) PPARASMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL11722901 0.85 PPARA (0.62) PPARASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7501852 0.85 PPARA (0.62) PPARASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL11717092 0.85 PPARA (0.62) PPARASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL4551138 0.82 SMN1; SMN2 (0.54) PPARASMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL4551128 0.81 PPARA (0.51) PPARASMN1; SMN2RAB9ANPC1MAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060247288-A1 Method for manufacturing isoxazole derivative or dihydroisoxazole derivative GAKUIN, RIKKYO (JP) 2006-11-02 US claimed
US-7495107-B2 Method for manufacturing isoxazole derivative or dihydroisoxazole derivative RIKKYO GAKUIN (JP) 2009-02-24 US disclosed
US-20060247288-A1 Method for manufacturing isoxazole derivative or dihydroisoxazole derivative GAKUIN, RIKKYO (JP) 2006-11-02 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-20060247288-A1 Method for manufacturing isoxazole derivative or dihydroisoxazole derivative CYP3A7, NDUFS7, IDH3A PPARA 4148/4885SMN1; SMN2 4090/4885RAB9A 4172/4885

“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.