SCHEMBL27718005

SCHEMBL27718005

Nc1ccc(Oc2ccc(-c3ccc(Oc4ccc(N)cc4)c(N)c3)cc2N)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.53
ALDH1A1 P00352 6/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
KDM4E B2RXH2 1/20 0.53
CYP2D6 P10635 1/20 0.53
HPGD P15428 1/20 0.53
CYP3A4 P08684 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
TSHR P16473 1/20 0.52
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
MITF O75030 1/20 0.47
GAA P10253 1/20 0.47
GFER P55789 1/20 0.47
NLRP1 Q9C000 1/20 0.47

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
SCHEMBL25135225 0.91 NCOA1 (0.57) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3784764 0.89 CYP3A4 (0.59) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL27741074 0.88 MAPT (0.53) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL28806097 0.88 MAPT (0.53) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL30744926 0.87 MAPT (0.57) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL362820 0.87 MAPT (0.57) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7806773 0.85 MAPT (0.59) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL27736615 0.83 ALDH1A1 (0.46) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL30393807 0.82 CYP1A2 (0.65) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL29866044 0.81 CYP3A4 (0.54) MAPTALDH1A1SMN1; SMN2MEN1KMT2A

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
CN-101293843-A Method for preparing 3,3'-diamino--4,4'-di(4-aminophenoxy)biphenyl UNIV DONGHUA (CN) 2008-10-29 CN disclosed
CN-101293843-A Method for preparing 3,3'-diamino--4,4'-di(4-aminophenoxy)biphenyl UNIV DONGHUA (CN) 2008-10-29 CN disclosed