SCHEMBL611403

SCHEMBL611403

C=CC(=O)N(CCC1CCCO1)CCC1CCCO1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
USP2 O75604 1/20 0.37
HPGD P15428 5/20 0.36
TP53 P04637 1/20 0.36
ALOX12 P18054 1/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HTT P42858 1/20 0.35
OXTR P30559 2/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL611099 0.83 OXTR (0.43) LMNASMN1; SMN2POLBUSP2HPGD
SCHEMBL21828769 0.81 LMNA (0.42) LMNASMN1; SMN2POLBUSP2HPGD
SCHEMBL610492 0.81 ZDHHC20 (0.33) ALDH1A1
SCHEMBL15663014 0.78 OXTR (0.40) LMNASMN1; SMN2POLBUSP2HPGD
SCHEMBL15715628 0.78 OXTR (0.40) LMNASMN1; SMN2POLBUSP2HPGD
SCHEMBL15694271 0.76 OXTR (0.38) LMNAPOLBHPGDTP53KMT2A
SCHEMBL24504354 0.75 LMNA (0.44) LMNASMN1; SMN2POLBUSP2HPGD
Acrylic Acid SCHEMBL27616849 0.73 ALDH1A1 (0.41) LMNASMN1; SMN2POLBUSP2HPGD
SCHEMBL10704702 0.72 ALDH1A1 (0.35) ALDH1A1
SCHEMBL21869514 0.72 GAA (0.36) LMNASMN1; SMN2POLBTP53KMT2A

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