SCHEMBL609888

SCHEMBL609888

CC(SC(=O)c1ccccc1)N(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
PGR P06401 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
KCNH2 Q12809 1/20 0.41
GPR139 Q6DWJ6 1/20 0.41
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
MAPT P10636 2/20 0.40
ATM Q13315 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
XBP1 P17861 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RECQL P46063 1/20 0.39
ALDH1A1 P00352 2/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL611288 0.80 PGR (0.57) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL6057193 0.79 CES2 (0.50) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL16044915 0.79 MAPT (0.45) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL6830394 0.78 LMNA (0.44) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL6575624 0.76 SMN1; SMN2 (0.44) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL6578239 0.76 SMN1; SMN2 (0.44) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL7546809 0.76 SMN1; SMN2 (0.44) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL10979998 0.76 GPR139 (0.42) KMT2APGRADRA2AADRA2BHTR2A
SCHEMBL619506 0.75 TSHR (0.41) KMT2APGRADRA2AADRA2BHTR2A
Hydrochloric Acid SCHEMBL11106436 0.74 SMN1; SMN2 (0.42) KMT2APGRADRA2AADRA2BHTR2A

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