SCHEMBL21418042

SCHEMBL21418042

CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 10/20 0.48
▸ MMP9 P14780 7/20 0.48
▸ MMP8 P22894 6/20 0.48
▸ MMP1 P03956 10/20 0.41
▸ MMP3 P08254 7/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.38
▸ MMP13 P45452 2/20 0.37
▸ MMP7 P09237 2/20 0.36
▸ FCER2 P06734 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ MMP12 P39900 1/20 0.35

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
SCHEMBL22915324 0.80 FFAR2 (0.32) —
SCHEMBL24923981 0.78 MMP1 (0.35) MMP9MMP1
SCHEMBL14546925 0.75 MMP9 (0.37) MMP2MMP9MMP8MMP1MMP3
SCHEMBL28364562 0.75 MMP2 (0.56) MMP2MMP9MMP8MMP1MMP3
SCHEMBL18762548 0.75 MMP2 (0.56) MMP2MMP9MMP8MMP1MMP3
SCHEMBL21895921 0.73 MMP2 (0.58) MMP2MMP9MMP8MMP1MMP3
SCHEMBL18048547 0.71 MMP2 (0.36) MMP2MMP9MMP8MMP1
SCHEMBL18048546 0.71 MMP2 (0.36) MMP2MMP9MMP8MMP1
SCHEMBL23520330 0.71 ALDH1A1 (0.64) MMP2MMP9MMP8MMP1MMP3
SCHEMBL14198796 0.71 ALDH1A1 (0.64) MMP2MMP9MMP8MMP1MMP3

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-3545974-A1 MEDICAL USE OF ANTI-C MET ANTIBODY-CYTOTOXIC DRUG CONJUGATE Suzhou Suncadia Biopharmaceuticals Co., Ltd. (CN) 2019-10-02 — — EP disclosed
Send feedback