SCHEMBL610092

SCHEMBL610092

S=C(c1ccccc1)c1ccc(N2CCOCC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.64
KDM4E B2RXH2 3/20 0.64
HPGD P15428 2/20 0.64
ALOX15 P16050 2/20 0.64
HSD17B10 Q99714 2/20 0.64
LMNA P02545 3/20 0.60
MAPT P10636 9/20 0.56
SMN1; SMN2 Q16637 6/20 0.56
RAB9A P51151 6/20 0.56
NPC1 O15118 5/20 0.56
EPHX1 P07099 1/20 0.56
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MAOB P27338 1/20 0.54
KMO O15229 1/20 0.53
PIK3CD O00329 1/20 0.52
PIK3CA P42336 1/20 0.52
PIK3CB P42338 1/20 0.52
PIK3CG P48736 1/20 0.52

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
SCHEMBL50238 0.82 SMN1; SMN2 (0.74) ALDH1A1HPGDALOX15HSD17B10LMNA
SCHEMBL14982132 0.82 ALDH1A1 (0.61) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL610475 0.82 LMNA (0.60) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL25803089 0.81 GSK3B (0.67) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL3948094 0.78 LMNA (0.95) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL254812 0.78 LMNA (0.95) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL2555823 0.78 LMNA (0.95) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL609170 0.78 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL15285555 0.78 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDALOX15HSD17B10
SCHEMBL14982101 0.77 NPC1 (0.76) ALDH1A1KDM4EHPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2857446-B1 TREAD RUBBER COMPOSITION AND PNEUMATIC TIRE SUMITOMO RUBBER IND (JP) 2018-03-07 EP disclosed
US-9790359-B2 Tread rubber composition and pneumatic tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2017-10-17 US disclosed
US-20150099823-A1 TREAD RUBBER COMPOSITION AND PNEUMATIC TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2015-04-09 US disclosed
EP-2857446-A1 TREAD RUBBER COMPOSITION AND PNEUMATIC TIRE Sumitomo Rubber Industries, Ltd. (JP) 2015-04-08 EP disclosed
US-8334339-B2 Conjugated diene-based polymer, conjugated diene-based polymer composition, and process for producing conjugated diene-based polymer SUMITOMO CHEMICAL CO., LTD. (JP) 2012-12-18 US disclosed
US-20120041134-A1 CONJUGATED DIENE-BASED POLYMER, CONJUGATED DIENE-BASED POLYMER COMPOSITION, AND PROCESS FOR PRODUCING CONJUGATED DIENE-BASED POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed