SCHEMBL18712342

SCHEMBL18712342

C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)C2CCC(CN3C(=O)CC(SCCC(=O)N(C)[C@@H](C)C(=O)O)C3=O)CC2)CSSC[C@@H](C(=O)N[C@H](CO)[C@@H](C)O)NC1=O

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 10/20 0.65
▸ SSTR2 P30874 16/20 0.64
▸ SSTR5 P35346 12/20 0.64
▸ SSTR3 P32745 5/20 0.62

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
SCHEMBL21312929 0.84 SSTR4 (0.69) SSTR4SSTR2SSTR5SSTR3
SCHEMBL23901126 0.81 SSTR2 (0.88) SSTR4SSTR2SSTR5SSTR3
SCHEMBL23482744 0.81 SSTR2 (0.88) SSTR4SSTR2SSTR5SSTR3
SCHEMBL24064978 0.81 SSTR2 (0.83) SSTR4SSTR2SSTR5SSTR3
SCHEMBL25504914 0.81 SSTR2 (0.87) SSTR4SSTR2SSTR5SSTR3
SCHEMBL22388803 0.81 SSTR2 (0.87) SSTR4SSTR2SSTR5SSTR3
SCHEMBL22389054 0.81 SSTR2 (0.87) SSTR4SSTR2SSTR5SSTR3
SCHEMBL17404670 0.81 SSTR2 (0.69) SSTR4SSTR2SSTR5SSTR3
SCHEMBL19542335 0.80 SSTR2 (0.69) SSTR4SSTR2SSTR5SSTR3
SCHEMBL18089372 0.80 SSTR4 (0.81) SSTR4SSTR2SSTR5SSTR3

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-9750818-B2 Targeted conjugates and particles and formulations thereof TARVEDA THERAPEUTICS, INC. (US) 2017-09-05 — — US disclosed
US-20170095569-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2017-04-06 — — 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-20170095569-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR5, SSTR1, SSTR4 SSTR4 3/4885SSTR2 4/4885SSTR5 1/4885

“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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