SCHEMBL11334206

SCHEMBL11334206

Cc1cccc(C)c1NCc1nncn1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PTGES O14684 9/20 0.39
▸ NPC1 O15118 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ PDE1A P54750 1/20 0.35
▸ PDE1B Q01064 1/20 0.35
▸ PDE1C Q14123 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TP53 P04637 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CBLB Q13191 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ BRPF1 P55201 1/20 0.33
▸ PARP15 Q460N3 1/20 0.33
▸ PARP10 Q53GL7 1/20 0.33
▸ TNKS2 Q9H2K2 1/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33

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
SCHEMBL11326369 0.89 KMT2A (0.44) L3MBTL1PTGESLMNATP53KMT2A
SCHEMBL11335170 0.81 KCNH2 (0.38) PDE1APDE1BPDE1CMAPK1TP53
SCHEMBL11324522 0.80 PDE1A (0.38) PDE1APDE1BPDE1CMAPK1KMT2A
SCHEMBL11325101 0.75 PTGES (0.47) L3MBTL1PTGESNPC1PKMRAB9A
SCHEMBL11323821 0.75 CBLB (0.37) NPC1RAB9AMAPK1TP53CBLB
SCHEMBL11326314 0.74 PTGES (0.46) L3MBTL1PTGESNPC1PKMRAB9A
SCHEMBL10716494 0.73 PTGES (0.46) L3MBTL1PTGESNPC1PKMRAB9A
SCHEMBL11159236 0.71 L3MBTL1 (0.44) L3MBTL1PTGESNPC1PKMRAB9A
SCHEMBL11336736 0.71 PTGES (0.47) L3MBTL1PTGESNPC1PKMRAB9A
SCHEMBL10719178 0.71 PTGES (0.55) L3MBTL1PTGESKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4267338-A INTERMEDIATES IN THE PRODUCTION OF N-AZOLYLALKYL-HALOGENOACETANILIDE HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-05-12 — — US disclosed
EP-0003540-B1 N-AZOLYLALKYL ANILINES AND PROCESS FOR THEIR PREPARATION BAYER AG (DE) 1980-10-01 — — EP disclosed
EP-0003540-A2 N-azolylalkyl anilines and process for their preparation BAYER AG (DE) 1979-08-22 — — EP disclosed
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