SCHEMBL7076948

SCHEMBL7076948

NC(N)C(O)c1ccn[nH]1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
HCAR2 Q8TDS4 1/20 0.34
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
HRH2 P25021 1/20 0.33
MAPK1 P28482 1/20 0.33
IDO1 P14902 1/20 0.31
SCN4A P35499 1/20 0.30
PDPK1 O15530 1/20 0.30

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 SCHEMBL17275441 0.82 ALDH1A1 (0.42) KMT2AATMKDM4EL3MBTL1HCAR2
SCHEMBL26815026 0.78 KDM4E (0.46) KMT2AATMKDM4EL3MBTL1HCAR2
SCHEMBL2555709 0.73
SCHEMBL27730790 0.72
SCHEMBL17282889 0.72 L3MBTL1 (0.42) KMT2AATMKDM4EL3MBTL1HCAR2
Hydrochloric Acid SCHEMBL23610812 0.71 KDM4E (0.47) KMT2AATMKDM4EL3MBTL1HCAR2
SCHEMBL27736453 0.69 USP2 (0.42) KMT2AATMKDM4EL3MBTL1HCAR2
SCHEMBL2495803 0.68
SCHEMBL2542762 0.68
SCHEMBL19930566 0.68 KMT2A (0.42) KMT2AATMKDM4EL3MBTL1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003068177-A2 TWO STEP PERMANENT COLOURING OF HAIR UNILEVER PLC (GB) 2003-08-21 WO claimed
EP-2914346-A1 PROCESS FOR STRAIGHTENING AND DYEING HAIR Kao Corporation (JP) 2015-09-09 EP disclosed
WO-2014068102-A2 PROCESS FOR DYEING AND STRAIGHTENING HAIR KAO CORPORATION (JP) 2014-05-08 WO disclosed
WO-2014067702-A1 PROCESS FOR STRAIGHTENING AND DYEING HAIR KAO CORPORATION (JP) 2014-05-08 WO disclosed
WO-2003068177-A2 TWO STEP PERMANENT COLOURING OF HAIR UNILEVER PLC (GB) 2003-08-21 WO disclosed