SCHEMBL13699289

SCHEMBL13699289

Cc1ccc(C(C)C(N)N)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.42
ACHE P22303 5/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALOX5 P09917 1/20 0.41
MAOA P21397 2/20 0.40
CA7 P43166 2/20 0.40
MAOB P27338 1/20 0.40
ADRB2 P07550 1/20 0.37
LMNA P02545 1/20 0.34
GBA1 P04062 1/20 0.34
BCHE P06276 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
STAT3 P40763 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP19A1 P11511 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
SCHEMBL6546299 0.83 ACHE (0.53) CHRNA7ACHETDP1ALOX5MAOA
SCHEMBL20807949 0.82 CHRNA7 (0.41) CHRNA7ACHETDP1ALOX5MAOA
SCHEMBL334558 0.78 ADRB2 (0.59) CHRNA7ACHETDP1ALOX5MAOA
SCHEMBL353336 0.78 ADRB2 (0.59) CHRNA7ACHETDP1ALOX5MAOA
SCHEMBL248672 0.78 ADRB2 (0.59) CHRNA7ACHETDP1ALOX5MAOA
SCHEMBL19200933 0.78 ACHE (0.47) CHRNA7ACHETDP1ALOX5MAOA
SCHEMBL9368549 0.77 MAOA (0.39) CHRNA7ACHETDP1ALOX5MAOA
Bromide SCHEMBL25270751 0.76 ADRB2 (0.56) CHRNA7ACHETDP1ALOX5MAOA
SCHEMBL4536748 0.76 DPP4 (0.52) MAOALMNAALDH1A1
Hydrochloric Acid SCHEMBL29064863 0.76 ADRB2 (0.56) CHRNA7ACHETDP1ALOX5MAOA

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
EP-1672003-B1 Coating liquid and electrophotographic photoreceptor prepared using the coating liquid RICOH KK (JP) 2009-09-02 EP disclosed