SCHEMBL25361722

SCHEMBL25361722

C=CCOC(=O)CCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NC(Cc1ccccc1)C(=O)NC(CCCCNC(c1ccccc1)(c1ccccc1)c1ccc(C)cc1)C(=O)Nc1ccc(COC(=O)Oc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 9/20 0.43
▸ SSTR3 P32745 1/20 0.39
▸ CTSL P07711 3/20 0.37
▸ TGM2 P21980 1/20 0.35
▸ SIRT2 Q8IXJ6 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ GRB2 P62993 1/20 0.34

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
SCHEMBL25361716 1.00 PTPN1 (0.43) PTPN1SSTR3CTSLTGM2SIRT2
SCHEMBL29649478 0.93 SSTR3 (0.44) PTPN1SSTR3CTSLSIRT2SIRT1
SCHEMBL25361270 0.88 PTPN1 (0.46) PTPN1SIRT2SIRT1GRB2
SCHEMBL25361276 0.88 PTPN1 (0.46) PTPN1SIRT2SIRT1GRB2
SCHEMBL29649568 0.85 MAPT (0.43) —
SCHEMBL25361958 0.84 SSTR3 (0.50) SSTR3CTSLSIRT2SIRT1
SCHEMBL25361946 0.84 SSTR3 (0.50) SSTR3CTSLSIRT2SIRT1
SCHEMBL26015625 0.84 SSTR3 (0.48) PTPN1SSTR3CTSLSIRT2SIRT1
SCHEMBL18102693 0.82 SSTR3 (0.51) SSTR3CTSLSIRT2SIRT1
SCHEMBL12683247 0.81 SSTR3 (0.47) PTPN1SSTR3CTSLGRB2

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-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 — — 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-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF NDC1, KIFC1, SDCBP PTPN1 754/4885SSTR3 3591/4885CTSL 1742/4885

“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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