SCHEMBL25401869

SCHEMBL25401869

CC(C)C(NC(=O)CCOCCOCCOCCOCCNC(=O)CCN1C(=O)C=CC1=O)C(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ OPRK1 P41145 2/20 0.38
▸ SIRT5 Q9NXA8 1/20 0.37
▸ MAPT P10636 5/20 0.37
▸ TDP1 Q9NUW8 5/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ GLA P06280 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ PAX8 Q06710 1/20 0.37
▸ AKT1 P31749 1/20 0.37
▸ PLK1 P53350 2/20 0.35
▸ NPSR1 Q6W5P4 3/20 0.35
▸ FAP Q12884 2/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SDCBP O00560 1/20 0.34
▸ SDC2 P34741 1/20 0.34
▸ GLP1R P43220 1/20 0.34
▸ SIRT2 Q8IXJ6 2/20 0.33
▸ SIRT1 Q96EB6 2/20 0.33

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
SCHEMBL21450348 1.00 CA1 (0.38) CA1CA2OPRK1SIRT5MAPT
SCHEMBL14138390 0.89 OPRK1 (0.40) OPRK1FAPGLP1R
SCHEMBL22134444 0.89 AKT1 (0.37) CA1CA2SIRT5MAPTTDP1
SCHEMBL21570028 0.89 FAP (0.39) OPRK1FAPGLP1R
SCHEMBL19026412 0.89 FAP (0.39) OPRK1FAPGLP1R
SCHEMBL24898929 0.89 FAP (0.39) OPRK1FAPGLP1R
SCHEMBL22702620 0.89 FAP (0.39) OPRK1FAPGLP1R
SCHEMBL30483105 0.89 FAP (0.39) OPRK1FAPGLP1R
SCHEMBL31045340 0.88 CA1 (0.41) CA1CA2SIRT5MAPTTDP1
SCHEMBL17841862 0.88 GLP1R (0.41) CA1CA2GAAAKT1PLK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230381321-A1 CAMPTOTHECIN CONJUGATES SEAGEN INC. 2023-11-30 — — US disclosed
WO-2023178289-A2 CAMPTOTHECIN CONJUGATES SEAGEN INC. (US) 2023-09-21 — — WO 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-20230381321-A1 CAMPTOTHECIN CONJUGATES DCLRE1A, TOP2A, PAICS CA1 1113/4885CA2 4244/4885OPRK1 4573/4885

“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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