SCHEMBL25361946

SCHEMBL25361946

Cc1ccc(C(NCCCC[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)O)C(=O)Nc2ccc(COC(=O)Oc3ccc([N+](=O)[O-])cc3)cc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SSTR3 P32745 1/20 0.50
▸ CTSL P07711 3/20 0.41
▸ HTR2A P28223 1/20 0.40
▸ SIRT2 Q8IXJ6 6/20 0.39
▸ SIRT1 Q96EB6 5/20 0.39
▸ HDAC8 Q9BY41 2/20 0.38
▸ SIRT3 Q9NTG7 3/20 0.38
▸ SIRT5 Q9NXA8 2/20 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
SCHEMBL25361958 1.00 SSTR3 (0.50) SSTR3CTSLHTR2ASIRT2SIRT1
SCHEMBL18102693 0.91 SSTR3 (0.51) SSTR3CTSLSIRT2SIRT1HDAC8
SCHEMBL29649478 0.90 SSTR3 (0.44) SSTR3CTSLSIRT2SIRT1HDAC8
SCHEMBL25360831 0.90 MAPT (0.45) SSTR3HDAC8SIRT5
SCHEMBL25360818 0.90 MAPT (0.45) SSTR3HDAC8SIRT5
SCHEMBL15702069 0.90 SSTR3 (0.51) SSTR3CTSLHTR2ASIRT2SIRT1
SCHEMBL29649540 0.90 FOLH1 (0.45) SSTR3
SCHEMBL15702064 0.89 SSTR3 (0.52) SSTR3CTSLSIRT2SIRT1HDAC8
SCHEMBL29649549 0.88 SSTR3 (0.42) SSTR3CTSLHTR2ASIRT2SIRT1
SCHEMBL18788631 0.85 SSTR3 (0.65) SSTR3CTSLHTR2AHDAC8

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 3591/4885CTSL 1742/4885HTR2A 4236/4885

“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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