SCHEMBL11041884

SCHEMBL11041884

C1=CC(Cc2ccccc2)N(c2ccccc2)C=C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
GRM2 Q14416 1/20 0.35
SLC6A3 Q01959 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
CES2 O00748 3/20 0.34
CYP3A4 P08684 2/20 0.34
GAA P10253 1/20 0.34
PRMT3 O60678 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT1 Q99873 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
SCHEMBL27991314 0.79 SLC6A2 (0.33) SMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL27542732 0.78 ALDH1A1 (0.39) ALDH1A1HSD17B10CYP3A4PRMT3CARM1
SCHEMBL2728492 0.78 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1HSD17B10CYP3A4PRMT3
SCHEMBL2003312 0.76 CYP1A2 (0.37) CYP1A2CYP2C19LMNACYP2C9SMN1; SMN2
SCHEMBL27540147 0.75 MAOA (0.35) GAA
Bromide SCHEMBL27702376 0.73 MAOA (0.34) GAA
SCHEMBL27992891 0.71 POLB (0.32)
SCHEMBL27893678 0.71 POLB (0.32)
SCHEMBL14855927 0.70 PRMT3 (0.35) ALDH1A1HSD17B10CYP3A4PRMT3CARM1
SCHEMBL27858737 0.69 RECQL (0.32) RECQLSMN1; SMN2NPSR1ALDH1A1KDM4E

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-4436819-A QUANTIFYING, WITH COLOR CHANGE UPON REACTION ASSAY TEC ASSOCIATES, INC. (US) 1984-03-13 US claimed
US-4436819-A QUANTIFYING, WITH COLOR CHANGE UPON REACTION ASSAY TEC ASSOCIATES, INC. (US) 1984-03-13 US disclosed