SCHEMBL611035

SCHEMBL611035

C=C(C)c1ccc(N2CCCCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.56
MAPT P10636 8/20 0.56
L3MBTL1 Q9Y468 5/20 0.56
ALOX15 P16050 4/20 0.56
HPGD P15428 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
NPC1 O15118 9/20 0.51
RAB9A P51151 9/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C19 P33261 1/20 0.51
GFER P55789 1/20 0.51
SMN1; SMN2 Q16637 6/20 0.50
TP53 P04637 4/20 0.50
LMNA P02545 3/20 0.50
TSHR P16473 2/20 0.50
HSD17B10 Q99714 2/20 0.50
STAT1 P42224 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
KDM4E B2RXH2 6/20 0.49

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
SCHEMBL609043 1.00 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1ALOX15HPGD
SCHEMBL611411 0.98 MAPT (0.53) ALDH1A1MAPTL3MBTL1ALOX15HPGD
SCHEMBL609175 0.90 F2 (0.52) ALDH1A1MAPTL3MBTL1ALOX15HPGD
SCHEMBL10473961 0.83 ALDH1A1 (0.60) ALDH1A1MAPTL3MBTL1ALOX15HPGD
SCHEMBL10472913 0.83 ALDH1A1 (0.60) ALDH1A1MAPTL3MBTL1ALOX15HPGD
SCHEMBL9671475 0.83 MAPT (0.56) ALDH1A1MAPTL3MBTL1ALOX15HPGD
SCHEMBL9673663 0.83 MAPT (0.56) ALDH1A1MAPTL3MBTL1ALOX15HPGD
SCHEMBL6923963 0.82 NPC1 (0.56) ALDH1A1MAPTNPC1RAB9AGFER
SCHEMBL4770473 0.82 ALDH1A1 (0.58) ALDH1A1MAPTALOX15HPGDNPC1
SCHEMBL8237227 0.82 ALDH1A1 (0.58) ALDH1A1MAPTL3MBTL1ALOX15HPGD

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 11 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-8367765-B2 Conjugated diene-based polymer, conjugated diene-based polymer composition, and process for producing conjugated diene-based polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-05 US 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-8299179-B2 Conjugated diene-based polymer, conjugated diene-based polymer composition, and process for producing conjugated diene-based polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-30 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
US-20120041136-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
US-20120041135-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
US-20110275756-A1 CONJUGATED DIENE POLYMER, CONJUGATED DIENE POLYMER COMPOSITION, AND METHOD FOR PRODUCING CONJUGATED DIENE POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-10 US disclosed