SCHEMBL1844172

SCHEMBL1844172

COC(=O)CC1OC(=O)C=C1C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
USP2 O75604 1/20 0.40
TSHR P16473 1/20 0.39
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BRD4 O60885 1/20 0.33
SETD7 Q8WTS6 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 2/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 3/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
MIF P14174 2/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL30893395 0.87 ATM (0.40) TSHRALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL12410539 0.86 ALDH1A1 (0.36) GAAUSP2TSHRALDH1A1SMN1; SMN2
SCHEMBL7961619 0.80 GAA (0.42) GAAUSP2TSHRALDH1A1SMN1; SMN2
SCHEMBL4384894 0.74 KDM4E (0.36) GAATSHRALDH1A1SETD7HSD17B10
SCHEMBL10701200 0.74 MAPT (0.37) GAATSHRALDH1A1SETD7KMT2A
SCHEMBL27380646 0.66 GAA (0.43) GAAUSP2TSHRALDH1A1SMN1; SMN2
SCHEMBL17070546 0.66 USP2 (0.41) GAAUSP2TSHRALDH1A1SMN1; SMN2
SCHEMBL16950194 0.66 TSHR (0.42) GAAUSP2TSHRALDH1A1SMN1; SMN2
SCHEMBL7961617 0.65 GAA (0.40) GAAUSP2TSHRALDH1A1SMN1; SMN2
SCHEMBL21485110 0.65 GAA (0.37) GAAUSP2TSHRALDH1A1SMN1; SMN2

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-20110166301-A1 POLYESTERS, POLYURETHANES AND PROCESS FOR THEIR PRODUCTION KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2011-07-07 US disclosed
US-20110166301-A1 POLYESTERS, POLYURETHANES AND PROCESS FOR THEIR PRODUCTION KABUSHIKI KAISHA TOYOTA JIDOSHOKKI (JP) 2011-07-07 US disclosed
EP-2325227-A1 POLYESTER, POLYURETHANE AND METHODS FOR PRODUCING SAME Kabushiki Kaisha Toyota Jidoshokki (JP) 2011-05-25 EP 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-20110166301-A1 POLYESTERS, POLYURETHANES AND PROCESS FOR THEIR PRODUCTION PUF60, UFM1, B2M GAA 2538/4885USP2 336/4885TSHR 4574/4885

“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.