SCHEMBL23790725

SCHEMBL23790725

O=C(O)CON1C(=O)c2ccccc2C1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ PKM P14618 2/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CA12 O43570 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ TOP1 P11387 1/20 0.39
▸ STAT3 P40763 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
SCHEMBL20739466 0.79 RAB9A (0.41) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL4550852 0.78 RAB9A (0.48) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL26532210 0.78 RAB9A (0.42) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL19968631 0.78 RAB9A (0.45) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL18474061 0.77 RAB9A (0.47) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL24880037 0.76 RAB9A (0.48) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL24479509 0.75 RAB9A (0.40) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL21205742 0.75 RAB9A (0.43) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL20468205 0.75 RAB9A (0.43) RAB9ANPC1TP53SMN1; SMN2TSHR
SCHEMBL25575417 0.75 RAB9A (0.48) RAB9ANPC1TP53SMN1; SMN2TSHR

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-20210277056-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES AMBRX, INC. (US) 2021-09-09 — — 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-20210277056-A1 COMPOSITIONS CONTAINING, METHODS INVOLVING, AND USES OF NON-NATURAL AMINO ACID LINKED DOLASTATIN DERIVATIVES DDOST, DAD1, PTMS RAB9A 3226/4885NPC1 285/4885TP53 3648/4885

“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.

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