SCHEMBL6035159

SCHEMBL6035159

CCC(CC)c1nn(Cc2ccccc2)cc1/C=C/C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.64
SMN1; SMN2 Q16637 4/20 0.63
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
PKM P14618 1/20 0.59
ALDH1A1 P00352 3/20 0.57
KDM4E B2RXH2 1/20 0.57
ATM Q13315 1/20 0.49
LMNA P02545 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 1/20 0.44
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
PLA2G2A P14555 1/20 0.39
BACE1 P56817 1/20 0.38
PARP1 P09874 1/20 0.38
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER3 P43115 1/20 0.38

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
SCHEMBL6035164 1.00 GAA (0.64) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL6035049 0.89 GAA (0.65) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL6035042 0.89 GAA (0.65) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL6036134 0.83 SMN1; SMN2 (0.59) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL6035234 0.81 GAA (0.65) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL6035230 0.81 GAA (0.65) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL5407247 0.75 GAA (0.64) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL5407245 0.75 GAA (0.64) GAASMN1; SMN2MEN1KMT2APKM
SCHEMBL6034833 0.75 MAPT (0.40) GAASMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6036261 0.74 ALDH1A1 (0.54) SMN1; SMN2KMT2AALDH1A1KDM4ELMNA

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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 GAA 815/4885SMN1; SMN2 4408/4885MEN1 2048/4885

“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.