SCHEMBL2465013

SCHEMBL2465013

C=CCC(c1ccccc1)c1c[nH]c2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.57
SLC6A4 P31645 2/20 0.57
CYP2D6 P10635 1/20 0.57
KCNH2 Q12809 1/20 0.57
GPR84 Q9NQS5 3/20 0.57
MGAM O43451 5/20 0.56
GAA P10253 5/20 0.56
SI P14410 5/20 0.56
MGAM2 Q2M2H8 5/20 0.56
FFAR1 O14842 2/20 0.54
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
POLB P06746 1/20 0.48
SRC P12931 1/20 0.48

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
SCHEMBL27682914 0.84 GPR84 (0.61) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL27682946 0.82 GPR84 (0.62) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL14168804 0.80 GPR84 (0.64) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL2995918 0.79 HTR2A (0.51) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL6799478 0.79 MGAM (0.48) GPR84MGAMGAASIMGAM2
SCHEMBL13253129 0.79 MEN1 (0.74) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL7967556 0.79 GPR84 (0.62) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL1348944 0.79 MGAM (0.64) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL9309358 0.77 HTR2A (0.56) SLC6A2SLC6A4CYP2D6KCNH2GPR84
SCHEMBL7271235 0.76 GPR84 (0.58) SLC6A2SLC6A4CYP2D6KCNH2GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009046370-A2 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-04-09 WO claimed
EP-3519567-A1 ENGINEERED MICROORGANISMS FOR PRODUCTION OF COMMODITY CHEMICALS AND CELLULAR BIOMASS The Regents of The University of California (US) 2019-08-07 EP disclosed
WO-2018067458-A1 ENGINEERED MICROORGANISMS FOR PRODUCTION OF COMMODITY CHEMICALS AND CELLULAR BIOMASS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-04-12 WO disclosed
EP-3230463-A1 RAPID PRETREATMENT Sweetwater Energy, Inc. (US) 2017-10-18 EP disclosed
WO-2016094594-A1 RAPID PRETREATMENT SWEETWATER ENERGY, INC. (US) 2016-06-16 WO disclosed
WO-2015179243-A1 SUGAR SEPARATION AND PURIFICATION THROUGH FILTRATION SWEETWATER ENERGY, INC. (US) 2015-11-26 WO disclosed
WO-2011106576-A2 METHODS AND COMPOSITIONS FOR ENHANCED ENZYME ACTIVITY IN FERMENTING MICROORGANISMS QTEROS, INC. (US) 2011-09-01 WO disclosed
WO-2009046370-A2 BIOFUEL PRODUCTION BIO ARCHITECTURE LAB, INC. (US) 2009-04-09 WO disclosed