SCHEMBL20153040

SCHEMBL20153040

CC1Cc2ccccc2C(C)S1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.41
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
PRCP P42785 1/20 0.38
KDM1A O60341 4/20 0.37
PDPK1 O15530 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37

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
SCHEMBL13937548 0.71 SMN1; SMN2 (0.39) HTR2AHTR2CHTR2BPRCPPDPK1
SCHEMBL15897223 0.71 HTR2A (0.43) HTR2AHTR2CHTR2BPRCPPDPK1
SCHEMBL15320015 0.71 ACHE (0.40) HTR2C
SCHEMBL371454 0.70
SCHEMBL19388157 0.70
SCHEMBL14555189 0.70 HTR2A (0.50) OPRM1HTR2AHTR2CHTR2BGRIN2D
SCHEMBL31554961 0.70
SCHEMBL12797873 0.70 MAPT (0.41) OPRM1HTR2AHTR2CHTR2BPDPK1
SCHEMBL15319341 0.69 GID4 (0.38) KDM1A
Ammonia Solution, Strong SCHEMBL11220000 0.69 HTR2A (0.48) OPRM1HTR2AHTR2CHTR2BGRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10562987-B2 Polymers produced via use of quinolinyldiamido transition metal complexes and vinyl transfer agents EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-02-18 US disclosed
US-20180134816-A1 Polymers Produced via Use of Quinolinyldiamido Transition Metal Complexes and Vinyl Transfer Agents EXXONMOBIL CHEMICAL PATENTS INC. 2018-05-17 US disclosed