SCHEMBL26015665

SCHEMBL26015665

CNCCCCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)CCOCCOCCOCCOCCOCCOCCN=[N+]=[N-])C(=O)Nc1ccc(C(O)C(=O)OC)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SSTR3 P32745 1/20 0.41
▸ FOLH1 Q04609 13/20 0.40
▸ CALCRL Q16602 1/20 0.39
▸ ITGB1 P05556 1/20 0.39
▸ ITGA5 P08648 1/20 0.39
▸ HDAC3 O15379 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ HDAC10 Q969S8 1/20 0.37
▸ HDAC11 Q96DB2 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ HDAC9 Q9UKV0 1/20 0.37
▸ HDAC5 Q9UQL6 1/20 0.37
▸ PSMB5 P28074 1/20 0.37
▸ EED O75530 1/20 0.37

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
SCHEMBL26015660 0.94 FOLH1 (0.41) FOLH1CALCRLITGB1ITGA5
SCHEMBL26024876 0.94 SSTR3 (0.42) SSTR3FOLH1CALCRLHDAC3HDAC4
SCHEMBL26015579 0.89 ITGB1 (0.43) FOLH1CALCRLITGB1ITGA5HDAC3
SCHEMBL25359665 0.89 FOLH1 (0.38) SSTR3FOLH1CALCRL
SCHEMBL25359656 0.89 FOLH1 (0.38) SSTR3FOLH1CALCRL
SCHEMBL26024879 0.87 CALCRL (0.42) FOLH1CALCRL
SCHEMBL25362331 0.83 FOLH1 (0.38) FOLH1CALCRL
SCHEMBL25362344 0.83 FOLH1 (0.38) FOLH1CALCRL
SCHEMBL26015581 0.83 FOLH1 (0.38) FOLH1CALCRLITGB1ITGA5
SCHEMBL26027705 0.81 FOLH1 (0.45) FOLH1ITGB1ITGA5

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 SSTR3 3591/4885FOLH1 433/4885CALCRL 3746/4885

“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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