SCHEMBL5360387

SCHEMBL5360387

O=C(O)C1=NN(c2ccc(S(=O)(=O)O)cc2)C(=O)C1N=Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ LMNA P02545 4/20 0.53
▸ NPC1 O15118 4/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ TDP1 Q9NUW8 2/20 0.53
▸ MAPK1 P28482 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ MEN1 O00255 7/20 0.53
▸ KMT2A Q03164 7/20 0.53
▸ CYP1A2 P05177 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ POLB P06746 2/20 0.46
▸ CYP2D6 P10635 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ ATM Q13315 1/20 0.44
▸ CYP2C19 P33261 1/20 0.42
▸ CYP2C9 P11712 1/20 0.39
▸ CASP3 P42574 1/20 0.39

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
SCHEMBL5360382 1.00 MAPT (0.53) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL5355824 0.95 MEN1 (0.58) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL5355831 0.95 MEN1 (0.58) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL839391 0.95 MEN1 (0.52) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL185928 0.95 MEN1 (0.52) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL839392 0.95 MEN1 (0.52) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL28836941 0.94 MEN1 (0.51) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL185927 0.94 MEN1 (0.51) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL29376127 0.94 MEN1 (0.54) MAPTALDH1A1LMNANPC1SMN1; SMN2
SCHEMBL3282817 0.90 MEN1 (0.47) MAPTALDH1A1LMNANPC1SMN1; SMN2

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-7306632-B2 Leave-in color conditioner HAIRMARKER LLC (US) 2007-12-11 — — US disclosed
US-20050198746-A1 Leave-in color conditioner HAIRMARKER LLC 2005-09-15 — — US disclosed
Send feedback