SCHEMBL23488987

SCHEMBL23488987

CCC(C)c1ccccc1COC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
ALDH1A1 P00352 3/20 0.47
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PPARA Q07869 1/20 0.37
PKM P14618 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL2131771 0.86 TSHR (0.47) TSHRALDH1A1PPARAPKMCYP1A2
SCHEMBL10583241 0.85 ALDH1A1 (0.52) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL29199291 0.80 ALDH1A1 (0.50) ALDH1A1MAPTL3MBTL1PKMCYP1A2
SCHEMBL9571993 0.79 TSHR (0.53) TSHRL3MBTL1PPARAKDM4E
SCHEMBL5255523 0.78 ALDH1A1 (0.65) ALDH1A1MAPTL3MBTL1PKMCYP1A2
SCHEMBL10178554 0.78 TSHR (0.52) TSHRALDH1A1MAPTL3MBTL1PPARA
SCHEMBL18427871 0.77 ALDH1A1 (0.47) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL8209562 0.77 ALDH1A1 (0.51) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL17193847 0.77 ALDH1A1 (0.47) ALDH1A1MAPTL3MBTL1CYP1A2CYP2C19
SCHEMBL11580414 0.77 ALDH1A1 (0.59) TSHRALDH1A1MAPTL3MBTL1CYP1A2

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-20210170045-A1 RELEASABLE ANTIBODY CONJUGATES FISH & RICHARDSON PC 2021-06-10 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-20210170045-A1 RELEASABLE ANTIBODY CONJUGATES BCR, CD47, RNASE1 TSHR 1139/4885ALDH1A1 263/4885MAPT 1404/4885

“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.