Benzene

Benzene

SCHEMBL27682124

CCn1cc(-c2cncc(Cl)c2)cn1.c1ccccc1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
CREBBP Q92793 1/20 0.40
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PI4KA P42356 1/20 0.40
PIK3CG P48736 1/20 0.40
PI4KB Q9UBF8 1/20 0.40
LRRK2 Q5S007 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
ACSS2 Q9NR19 1/20 0.39
DYRK1A Q13627 1/20 0.38
PIM1 P11309 1/20 0.38

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
Benzene SCHEMBL27682129 0.83 LRRK2 (0.47) KCNH2L3MBTL1KDM4EALDH1A1LMNA
Benzene SCHEMBL27682163 0.81 KCNH2 (0.41) KCNH2L3MBTL1KDM4EALDH1A1LMNA
SCHEMBL13354443 0.79 LRRK2 (0.49) KCNH2L3MBTL1KDM4EALDH1A1LMNA
SCHEMBL13086425 0.75 PIM1 (0.42) KCNH2KDM4EALDH1A1LMNAMAPT
SCHEMBL30635496 0.74 PIK3CD (0.47) KCNH2L3MBTL1KDM4EALDH1A1LMNA
SCHEMBL18487593 0.74 L3MBTL1 (0.65) KCNH2L3MBTL1KDM4EALDH1A1LMNA
Benzene SCHEMBL27662532 0.73 PIK3CD (0.44) KCNH2L3MBTL1KDM4EALDH1A1LMNA
SCHEMBL12369720 0.72 L3MBTL1 (0.65) L3MBTL1KDM4EALDH1A1LMNAMAPT
Benzene SCHEMBL27682259 0.72 CREBBP (0.46) KCNH2L3MBTL1KDM4EALDH1A1LMNA
SCHEMBL21744554 0.71 MKNK1 (0.55) PRMT5WDR77

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
CN-1980927-A Pyrazolopyridine derivatives ASTELLAS PHARMA INC (JP) 2007-06-13 CN claimed
CN-1980927-A Pyrazolopyridine derivatives ASTELLAS PHARMA INC (JP) 2007-06-13 CN disclosed