SCHEMBL11245402

SCHEMBL11245402

Cc1ccc(N=Nc2cc(C)c(O)cc2N)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 7/20 0.62
▸ RAB9A P51151 7/20 0.62
▸ MAPT P10636 6/20 0.62
▸ L3MBTL1 Q9Y468 5/20 0.62
▸ MAPK1 P28482 4/20 0.62
▸ PKM P14618 1/20 0.62
▸ ATM Q13315 1/20 0.62
▸ BRD4 O60885 4/20 0.55
▸ BRD3 Q15059 3/20 0.55
▸ BRD2 P25440 2/20 0.55
▸ BRDT Q58F21 2/20 0.55
▸ PHLPP2 Q6ZVD8 2/20 0.55
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ USP2 O75604 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ CREBBP Q92793 2/20 0.52
▸ SMARCA4 P51532 1/20 0.52
▸ BPTF Q12830 1/20 0.52

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
SCHEMBL11245399 1.00 NPC1 (0.62) NPC1RAB9AMAPTL3MBTL1MAPK1
SCHEMBL11239943 0.87 BRD4 (0.53) NPC1RAB9AMAPTL3MBTL1MAPK1
SCHEMBL11239947 0.87 BRD4 (0.53) NPC1RAB9AMAPTL3MBTL1MAPK1
SCHEMBL11239449 0.87 BRD4 (0.55) NPC1RAB9AMAPTL3MBTL1MAPK1
SCHEMBL11239443 0.87 BRD4 (0.55) NPC1RAB9AMAPTL3MBTL1MAPK1
SCHEMBL11236338 0.84 NPC1 (0.72) NPC1RAB9AMAPTL3MBTL1MAPK1
SCHEMBL11236335 0.84 NPC1 (0.72) NPC1RAB9AMAPTL3MBTL1MAPK1
SCHEMBL15496642 0.83 BRD4 (0.66) MAPTL3MBTL1BRD4BRD3BRD2
SCHEMBL11242221 0.82 BRD4 (0.64) NPC1RAB9AMAPTBRD4BRD3
SCHEMBL11242226 0.82 BRD4 (0.64) NPC1RAB9AMAPTBRD4BRD3

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-4323682-A BLEACHING CATALYSTS CIBA GEIGY AG (CH) 1982-04-06 — — US disclosed
US-4202698-A DYE BLEACH CATALYSTS CIBA-GEIGY AG (CH) 1980-05-13 — — US disclosed
Send feedback