SCHEMBL22117586

SCHEMBL22117586

NC(=O)C(CCCCNC(=O)O)NC(=O)C(N)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 1/20 0.51
▸ CTSL P07711 1/20 0.50
▸ PTPN2 P17706 1/20 0.49
▸ PTPN1 P18031 1/20 0.49
▸ CTSC P53634 1/20 0.48
▸ NPY4R P50391 3/20 0.46
▸ NPY1R P25929 2/20 0.46
▸ NPY2R P49146 2/20 0.46
▸ NPY5R Q15761 2/20 0.46
▸ SIRT2 Q8IXJ6 1/20 0.45

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
SCHEMBL22117585 1.00 KISS1R (0.51) KISS1RCTSLPTPN2PTPN1CTSC
SCHEMBL7785244 0.87 NPY4R (0.56) KISS1RCTSLCTSCNPY4RNPY1R
SCHEMBL17073781 0.87 CTSL (0.63) CTSLSIRT2
SCHEMBL6431108 0.86 MMP2 (0.56) CTSLCTSC
SCHEMBL28323436 0.86 MMP2 (0.56) CTSLCTSC
SCHEMBL30688828 0.86 MMP2 (0.56) CTSLCTSC
SCHEMBL22117384 0.86 NPY4R (0.64) KISS1RCTSLPTPN2PTPN1NPY4R
SCHEMBL22117385 0.86 NPY4R (0.64) KISS1RCTSLPTPN2PTPN1NPY4R
SCHEMBL17553458 0.85 PAX8 (0.52) KISS1RCTSLPTPN2PTPN1SIRT2
SCHEMBL29540489 0.85 CTSL (0.54) CTSLCTSC

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
EP-3898652-A1 MITOCHONDRIA-TARGETING PEPTIDES Stealth Biotherapeutics Corp (MC) 2021-10-27 — — EP disclosed
WO-2020131282-A1 MITOCHONDRIA-TARGETING PEPTIDES STEALTH BIOTHERAPEUTICS CORP. (MC) 2020-06-25 — — WO disclosed
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