SCHEMBL22784142

SCHEMBL22784142

N#Cc1cc(OCCc2ccccc2)c(OCCc2ccccc2)cc1C#N

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.54
MAOA P21397 1/20 0.54
FNTA P49354 4/20 0.52
FNTB P49356 4/20 0.52
PGGT1B P53609 4/20 0.52
CYP19A1 P11511 2/20 0.51
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
SIGMAR1 Q99720 5/20 0.49
EBP Q15125 1/20 0.49
TMEM97 Q5BJF2 1/20 0.49

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
SCHEMBL6957296 0.86 FNTA (0.52) MAOBMAOAFNTAFNTBPGGT1B
SCHEMBL4485604 0.81 FNTA (0.55) MAOBMAOAFNTAFNTBPGGT1B
SCHEMBL4604160 0.80 FNTA (0.43) MAOBMAOAFNTAFNTBPGGT1B
SCHEMBL8155625 0.80 FNTA (0.60) MAOBMAOAFNTAFNTBPGGT1B
SCHEMBL2036343 0.78 CYP19A1 (0.57) MAOBMAOAFNTAFNTBPGGT1B
SCHEMBL3752260 0.78 CYP19A1 (0.57) MAOBMAOACYP19A1CYP11B1CYP11B2
SCHEMBL80586 0.77 FNTA (0.50) MAOBMAOAFNTAFNTBPGGT1B
SCHEMBL17912813 0.76 CYP11B1 (0.56) CYP11B1CYP11B2
SCHEMBL7078940 0.76 FNTA (0.54) MAOBMAOAFNTAFNTBPGGT1B
SCHEMBL1154474 0.76 CYP11B1 (0.43) FNTAFNTBPGGT1BCYP19A1CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200392343-A1 COMPOSITION, CURED PRODUCT, COLOR FILTER, METHOD FOR PRODUCING COLOR FILTER, SOLID-STATE IMAGING ELEMENT, IMAGE DISPLAY DEVICE, AND COMPOUND FUJIFILM CORPORATION (JP) 2020-12-17 US disclosed