SCHEMBL30788017

SCHEMBL30788017

CC(C)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 6/20 0.64
▸ GHSR Q92847 6/20 0.61
▸ ECE1 P42892 5/20 0.59
▸ IL1RN P18510 5/20 0.59
▸ ERAP1 Q9NZ08 4/20 0.59
▸ ACE P12821 1/20 0.56

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
SCHEMBL29819949 0.98 GHSR (0.62) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL31004373 0.96 ERAP2 (0.61) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL30788023 0.96 ERAP2 (0.63) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL30416193 0.95 ECE1 (0.64) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL31583852 0.95 ERAP2 (0.63) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL29378588 0.95 ERAP2 (0.63) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL30929767 0.94 ERAP2 (0.58) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL30788022 0.94 ERAP2 (0.59) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL31232500 0.94 ERAP2 (0.63) ERAP2GHSRECE1IL1RNERAP1
SCHEMBL31583409 0.93 ERAP2 (0.60) ERAP2GHSRECE1IL1RNERAP1

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-20240042063-A1 LINKED AND OTHER pH-TRIGGERED COMPOUNDS UNIVERSITY OF RHODE ISLAND BOARD OF TRUSTEES 2024-02-08 — — 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-20240042063-A1 LINKED AND OTHER pH-TRIGGERED COMPOUNDS LIPA, PHOSPHO1, NGLY1 ERAP2 735/4885GHSR 1899/4885ECE1 1676/4885

“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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