SCHEMBL2589556

SCHEMBL2589556

Cc1c2ccccc2c(C)c2sccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
CYP3A4 P08684 3/20 0.38
HIF1A Q16665 2/20 0.38
HPGD P15428 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
RAB9A P51151 1/20 0.38
CASP7 P55210 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 4/20 0.35
TNKS O95271 1/20 0.34
PARP1 P09874 1/20 0.34
PARP15 Q460N3 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
TERT O14746 3/20 0.34
KCNA3 P22001 1/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 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
SCHEMBL203914 0.88 DYRK1A (0.34) TSHRRAB9AATML3MBTL1TERT
SCHEMBL10733659 0.86 CYP1A2 (0.35) TSHRCYP3A4HIF1AHPGDHSD17B10
SCHEMBL18775167 0.78 MAPT (0.33) TSHRCYP2A6MAPTALDH1A1KDM4E
SCHEMBL12036433 0.76 MAPT (0.32) TSHRMAPTALDH1A1KDM4EGAA
SCHEMBL20371351 0.76
SCHEMBL15277885 0.76 GPR35 (0.32) HSD17B10CASP1L3MBTL1KMT2AMAPT
SCHEMBL30099100 0.75 TNKS (0.41) TSHRHSD17B10TNKSPARP1PARP15
SCHEMBL12036432 0.74 MAPT (0.31) TSHRMAPTALDH1A1KDM4EGAA
SCHEMBL29379467 0.74 CYP1A2 (0.56) TSHRCYP3A4HIF1AHPGDHSD17B10
SCHEMBL377040 0.74 CYP1A2 (0.56) TSHRCYP3A4HIF1AHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9090834-B2 Ozonation conversion of heavy hydrocarbons for resource recovery UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-07-28 US disclosed
US-20130292297-A1 OZONATION CONVERSION OF HEAVY HYDROCARBONS FOR RESOURCE RECOVERY UNIVERSITY OF UTAH 2013-11-07 US disclosed
WO-2011137378-A2 OZONATION CONVERSION OF HEAVY HYDROCARBONS FOR RESOURCE RECOVERY UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2011-11-03 WO disclosed