SCHEMBL28824409

SCHEMBL28824409

CC(N)C(C)C1CCCO1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.35
HPGD P15428 2/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
GAA P10253 1/20 0.33
POLB P06746 2/20 0.33
RAB9A P51151 2/20 0.33
HSD17B10 Q99714 1/20 0.33
KMT2A Q03164 1/20 0.31
NOS2 P35228 1/20 0.31
NPC1 O15118 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
SCHEMBL14739011 0.81
SCHEMBL14738884 0.81
SCHEMBL22915204 0.81
SCHEMBL14738505 0.81
SCHEMBL2882789 0.81
SCHEMBL23041676 0.81
SCHEMBL20249096 0.81 L3MBTL1 (0.36) SMN1; SMN2HPGDALDH1A1L3MBTL1GAA
SCHEMBL22414058 0.78 SLC6A3 (0.38) SMN1; SMN2HPGDALDH1A1L3MBTL1GAA
SCHEMBL19264754 0.77 L3MBTL1 (0.34) SMN1; SMN2HPGDALDH1A1L3MBTL1GAA
SCHEMBL3509900 0.77 SMN1; SMN2 (0.38) SMN1; SMN2HPGDALDH1A1L3MBTL1GAA

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
CN-105254820-B A kind of preparation method of Early-strength polycarboxylate superplasticizer of carbon containing oxa- ring and products thereof 上海台界化工有限公司 2018-01-05 CN claimed
CN-105254820-A Preparation method of early-strength type polycarboxylate superplasticizer containing carbon-oxygen heterocyclic ring and product of early-strength type polycarboxylate superplasticizer SHANGHAI TAIJIE CHEMICAL CO LTD 2016-01-20 CN claimed
CN-105254820-B A kind of preparation method of Early-strength polycarboxylate superplasticizer of carbon containing oxa- ring and products thereof 上海台界化工有限公司 2018-01-05 CN disclosed
CN-105254820-A Preparation method of early-strength type polycarboxylate superplasticizer containing carbon-oxygen heterocyclic ring and product of early-strength type polycarboxylate superplasticizer SHANGHAI TAIJIE CHEMICAL CO LTD 2016-01-20 CN disclosed