SCHEMBL6976416

SCHEMBL6976416

[CH2]CCN(CCCC)C(C)C

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP8 P22894 1/20 0.30

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
SCHEMBL6975274 0.91 MMP1 (0.30) MMP1MMP2MMP3MMP8
SCHEMBL865548 0.87 MMP1 (0.36) MMP1MMP2MMP3MMP8
Water SCHEMBL28587222 0.85 TSHR (0.35) MMP1MMP2MMP3MMP8
Bromide SCHEMBL31364322 0.85 DNM1 (0.38) MMP1MMP2MMP3MMP8
Hydrochloric Acid SCHEMBL1428262 0.85 DNM1 (0.38) MMP1MMP2MMP3MMP8
SCHEMBL4275312 0.83 MMP1 (0.31) MMP1MMP2MMP3MMP8
SCHEMBL865701 0.82 FDPS (0.36) MMP1MMP2MMP3MMP8
SCHEMBL865718 0.82 DNM1 (0.43) MMP1MMP2MMP3MMP8
SCHEMBL10379743 0.80 DNM1 (0.48)
SCHEMBL11252414 0.80 DNM1 (0.48)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0870765-B1 AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS ZERIA PHARM CO LTD (JP) 2003-11-19 EP disclosed
US-5981557-A HAVING IMPROVING EFFECTS ON THE DYSMOTILITY IN THE GASTROINTESTINAL TRACT ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed
EP-0870765-A1 AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-10-14 EP disclosed