SCHEMBL19743580

SCHEMBL19743580

Cc1nn(C)c(N)c1-c1c(F)cccc1Br

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
POLB P06746 2/20 0.37
CDK8 P49336 1/20 0.37
ACVR1 Q04771 1/20 0.37
MAPK14 Q16539 1/20 0.35
HRH4 Q9H3N8 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
NMT1 P30419 1/20 0.32
HPGD P15428 2/20 0.32
PKM P14618 1/20 0.32
MAOA P21397 2/20 0.32
HTR2C P28335 2/20 0.32
HTR2B P41595 2/20 0.32
HTR7 P34969 1/20 0.32
HTR1A P08908 1/20 0.32
MAOB P27338 1/20 0.32
HTR5A P47898 1/20 0.32
JAK2 O60674 1/20 0.31

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
SCHEMBL1726326 0.89 MAPT (0.59) MAPTPOLBCDK8ACVR1MAPK14
SCHEMBL29039033 0.82 MAPT (0.51) MAPTPOLBCDK8ACVR1MAPK14
SCHEMBL28195585 0.76 MAPT (0.60) MAPTPOLBCDK8ACVR1SMN1; SMN2
SCHEMBL28294976 0.76 MAPT (0.60) MAPTPOLBCDK8ACVR1MAPK14
SCHEMBL27207771 0.76 PKM (0.47) MAPTCDK8ACVR1SMN1; SMN2NPC1
SCHEMBL15952575 0.76 MAPT (0.39) MAPTPOLBCDK8ACVR1SMN1; SMN2
SCHEMBL29097494 0.75 MAPT (0.50) MAPTPOLBCDK8ACVR1MAPK14
SCHEMBL30151194 0.75 MAPT (0.50) MAPTPOLBCDK8ACVR1MAPK14
SCHEMBL15639816 0.72 BRD4 (0.45) MAPTPOLBCDK8ACVR1SMN1; SMN2
SCHEMBL30415275 0.72 MAPT (0.46) MAPTPOLBCDK8ACVR1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118102874-A Active compound combinations and fungicide compositions comprising them 拜耳公司 2024-05-28 CN claimed
CN-116234444-A Mixtures with insecticidal activity comprising sulfur-containing heterocyclylalkoxy compounds, oxides or salts thereof 皮埃企业有限公司 2023-06-06 CN claimed
CN-118102874-A Active compound combinations and fungicide compositions comprising them 拜耳公司 2024-05-28 CN disclosed
CN-116234444-A Mixtures with insecticidal activity comprising sulfur-containing heterocyclylalkoxy compounds, oxides or salts thereof 皮埃企业有限公司 2023-06-06 CN disclosed
EP-3601279-A1 TRICYCLIC CARBOXAMIDES FOR CONTROLLING ARTHROPODS Bayer CropScience Aktiengesellschaft (DE) 2020-02-05 EP disclosed
WO-2017220491-A1 ACTIVE COMPOUND COMBINATIONS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-12-28 WO disclosed