SCHEMBL17775541

SCHEMBL17775541

Cc1cccc(CNN=Cc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.49
▸ RAB9A P51151 6/20 0.49
▸ NPC1 O15118 6/20 0.49
▸ LMNA P02545 5/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ POLB P06746 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ NPSR1 Q6W5P4 4/20 0.45
▸ MAPK1 P28482 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ HTT P42858 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ XBP1 P17861 1/20 0.44
▸ NOX1 Q9Y5S8 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43

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
SCHEMBL15604918 0.83 MAPT (0.59) MAPTRAB9ANPC1LMNAMEN1
SCHEMBL22360336 0.80 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EBACE1ACHE
SCHEMBL5545644 0.77 ACHE (0.48) MAPTLMNAALDH1A1HPGDTDP1
SCHEMBL9442365 0.76 RAB9A (0.74) MAPTRAB9ANPC1LMNAMEN1
SCHEMBL9442364 0.76 RAB9A (0.74) MAPTRAB9ANPC1LMNAMEN1
SCHEMBL11831264 0.73 HTT (0.63) MAPTRAB9ANPC1HPGDNPSR1
SCHEMBL11674750 0.72 NOX1 (0.67) MAPTRAB9ANPC1LMNAMEN1
SCHEMBL11674747 0.72 NOX1 (0.67) MAPTRAB9ANPC1LMNAMEN1
SCHEMBL202284 0.72 RAB9A (0.56) MAPTRAB9ANPC1MEN1KMT2A
SCHEMBL2702244 0.72 RAB9A (0.56) MAPTRAB9ANPC1MEN1KMT2A

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
WO-2016080749-A1 A PLURALITY OF DOPANT MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-05-26 — — WO disclosed
Send feedback