SCHEMBL7126340

SCHEMBL7126340

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nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TSHR P16473 3/20 0.42
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC10 Q969S8 1/20 0.30
HDAC11 Q96DB2 1/20 0.30

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
SCHEMBL2465319 1.00 ALDH1A1 (0.46) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL7913134 0.83 TSHR (0.42) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL27629908 0.79 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2
SCHEMBL9462040 0.78 ALDH1A1 (0.43) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL27843960 0.78 TSHR (0.38) ALDH1A1TSHR
SCHEMBL5792192 0.77 TSHR (0.46) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL4166708 0.76 ALDH1A1 (0.40) ALDH1A1TSHRCHRM1TDP1TRPV1
SCHEMBL11516329 0.74 ALDH1A1 (0.65) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL1270348 0.74
SCHEMBL3909058 0.74

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-20030083225-A1 Organolipic substance NATIONAL BANK OF CANADA (CA) 2003-05-01 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-20030083225-A1 Organolipic substance SGMS2, SGMS1, CYP2S1 ALDH1A1 919/4885TSHR 1902/4885CHRM2 298/4885

“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.