SCHEMBL23893967

SCHEMBL23893967

CNC(=O)C(Cc1ccccc1)NC(=O)C(CCCCN)NSC

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 13/20 0.53
▸ MMP1 P03956 12/20 0.53
▸ MMP3 P08254 11/20 0.53
▸ MMP8 P22894 2/20 0.51
▸ MMP7 P09237 3/20 0.50
▸ MMP9 P14780 1/20 0.50
▸ GNPAT O15228 1/20 0.50

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
SCHEMBL24065170 0.91 GNPAT (0.50) MMP2GNPAT
SCHEMBL20159738 0.88 MMP2 (0.57) MMP2MMP1MMP3MMP8MMP7
SCHEMBL14821599 0.86 MMP1 (0.57) MMP2MMP1MMP3MMP8MMP7
SCHEMBL13344145 0.85 GHSR (0.57) MMP2MMP1MMP3MMP8
SCHEMBL23901052 0.85 MMP2 (0.54) MMP2MMP1MMP3MMP8MMP7
SCHEMBL20356789 0.85 GHSR (0.57) MMP2MMP1MMP3MMP8
SCHEMBL25062089 0.82 MMP2 (0.53) MMP2MMP1MMP3MMP7
SCHEMBL25936169 0.81 GNPAT (0.49) MMP2GNPAT
SCHEMBL21788139 0.80 GNPAT (0.53) MMP2MMP1MMP3GNPAT
SCHEMBL30917923 0.80 GNPAT (0.61) MMP2GNPAT

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
EP-3888691-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LIKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS Hangzhou Dac Biotech Co., Ltd. (CN) 2021-10-06 — — EP disclosed
Send feedback