SCHEMBL2186756

SCHEMBL2186756

Nc1ccc(CNc2cccc(N)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.50
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
GFER P55789 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTR6 P50406 1/20 0.46
DDX3X O00571 1/20 0.44
FCGR3B O75015 1/20 0.44
FCGR1A P12314 1/20 0.44
FCGR2A P12318 1/20 0.44
NOS1 P29475 2/20 0.43
NOS2 P35228 1/20 0.42
ALDH1A1 P00352 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42

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
Hydrochloric Acid SCHEMBL456625 0.98 CYP19A1 (0.48) CYP19A1KDM4EMEN1LMNAGAA
SCHEMBL5157913 0.89 KDM4E (0.57) KDM4EMEN1LMNAGAAMAPT
SCHEMBL29922555 0.89 KDM4E (0.57) KDM4EMEN1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL453244 0.87 MAPT (0.55) KDM4EMEN1LMNAGAAMAPT
SCHEMBL11248387 0.86 MAOA (0.48) CYP19A1KDM4EMEN1LMNAGAA
Hydrochloric Acid SCHEMBL2266592 0.86 KDM4E (0.42) KDM4EMEN1LMNAGAAMAPT
Hydrochloric Acid SCHEMBL11247122 0.85 MAOA (0.50) CYP19A1KDM4EMEN1LMNAGAA
SCHEMBL1577113 0.85 KDM4E (0.47) CYP19A1KDM4EMEN1LMNAGAA
Hydrochloric Acid SCHEMBL11247111 0.85 MAOA (0.50) CYP19A1KDM4EMEN1LMNAGAA
SCHEMBL11935895 0.84 EGFR (0.52) KDM4EMEN1LMNAGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3733827-A1 DELIVERY PARTICLES The Procter & Gamble Company (US) 2020-11-04 EP disclosed
EP-1484048-B1 Hair colouring compositions NOXELL CORP (US) 2019-01-02 EP disclosed
EP-2343037-B1 Thickened hair colourant and bleaching compositions PROCTER & GAMBLE (US) 2012-05-09 EP disclosed
EP-2343037-A1 Thickened hair colourant and bleaching compositions The Procter & Gamble Company (US) 2011-07-13 EP disclosed