SCHEMBL8534377

SCHEMBL8534377

CCC(NC(=O)C(=O)NC(CC)N(C)C)N(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
GAA P10253 1/20 0.33
MMP1 P03956 2/20 0.32
MMP2 P08253 2/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
CHRNB2 P17787 2/20 0.31
CHRNA4 P43681 2/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
MMP3 P08254 1/20 0.31

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
SCHEMBL9702897 0.89 USP2 (0.32) USP2TSHRGAA
SCHEMBL28398512 0.87 TGFBR1 (0.39) USP2TSHR
SCHEMBL902118 0.85 ALDH1A1 (0.36) USP2TSHRMMP1MMP2CA12
SCHEMBL34096 0.85 TGFBR1 (0.44) USP2TSHR
Hydrochloric Acid SCHEMBL7945240 0.83 TGFBR1 (0.43)
SCHEMBL794227 0.83 USP2 (0.34) USP2TSHRMMP1MMP2CA12
Hydrochloric Acid SCHEMBL10858084 0.83 ALDH1A1 (0.35) USP2TSHRMMP1MMP2CA12
SCHEMBL9425063 0.83 USP2 (0.34) USP2TSHRMMP1MMP2CA12
SCHEMBL27816009 0.83 ALDH1A1 (0.36) USP2TSHRMMP1MMP2CA12
SCHEMBL186588 0.81 CHRNB2 (0.35) USP2TSHRMMP1MMP2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665258-B1 Piperidenyle compounds and their use as a photostabilizer for polymers RHODIA CHIMIE SA (FR) 1998-07-01 EP disclosed
EP-0388321-B1 Piperidinyle compounds and their use as a photostabilizer for polymers RHONE POULENC CHIMIE (FR) 1996-12-18 EP disclosed
EP-0665258-A2 Piperidenyle compounds and their use as a photostabilizer for polymers RHONE-POULENC CHIMIE (FR) 1995-08-02 EP disclosed
EP-0388321-A1 Piperidinyle compounds and their use as a photostabilizer for polymers RHONE-POULENC CHIMIE (FR) 1990-09-19 EP disclosed