SCHEMBL3165161

SCHEMBL3165161

CCC(CCNc1ccccc1)=C(C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 3/20 0.40
GAA P10253 1/20 0.39
ALOX5 P09917 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
KMT2A Q03164 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
NR4A1 P22736 1/20 0.38
HPGD P15428 1/20 0.37
FFAR1 O14842 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL13497083 0.78 ALDH1A1 (0.48) NAPRTHSD17B10MAPTALDH1A1SMN1; SMN2
SCHEMBL10665540 0.77 MAPT (0.52) NAPRTHSD17B10MAPTALDH1A1POLB
SCHEMBL19656197 0.75 ALDH1A1 (0.58) MAPTALDH1A1SMN1; SMN2ALOX5RAB9A
SCHEMBL11390171 0.73 ALDH1A1 (0.52) HSD17B10MAPTALDH1A1SMN1; SMN2POLB
Phenamino Methyl Acetic Acid SCHEMBL433918 0.73 POLB (0.59) HSD17B10MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL1454224 0.72 MAPT (0.50) NAPRTHSD17B10MAPTALDH1A1SMN1; SMN2
SCHEMBL11675821 0.71 HDAC3 (0.46) MAPTALDH1A1SMN1; SMN2ALOX5RAB9A
SCHEMBL505867 0.70 LMNA (0.55) HSD17B10MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL11674922 0.70 ALDH1A1 (0.48) MAPTALDH1A1SMN1; SMN2POLBALOX5
SCHEMBL18628037 0.70 ALDH1A1 (0.48) HSD17B10MAPTALDH1A1SMN1; SMN2POLB

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-2167559-A1 TWO OR MORE-COMPONENT SYSTEM CURED BY A REDOX INITIATOR SYSTEM WITH CONTROLLABLE WORKING LIFE, AND THE USE THEREOF Evonik Röhm GmbH (DE) 2010-03-31 EP disclosed
EP-2164884-A1 EMULSION POLYMER COMPRISING ACTIVATORS, PROCESS FOR PREPARATION THEREOF AND USE THEREOF IN TWO-COMPONENT OR MULTICOMPONENT SYSTEMS Evonik Röhm GmbH (DE) 2010-03-24 EP disclosed
WO-2009007255-A1 EMULSION POLYMER COMPRISING ACTIVATORS, PROCESS FOR PREPARATION THEREOF AND USE THEREOF IN TWO-COMPONENT OR MULTICOMPONENT SYSTEMS EVONIK RÖHM GMBH (DE) 2009-01-15 WO disclosed
WO-2009007253-A1 TWO OR MORE-COMPONENT SYSTEM CURED BY A REDOX INITIATOR SYSTEM WITH CONTROLLABLE WORKING LIFE, AND THE USE THEREOF EVONIK RÖHM GMBH (DE) 2009-01-15 WO disclosed