Benzene

Benzene

SCHEMBL10353060

CCc1nc(Cl)nc(Cl)n1.c1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 3/20 0.37
LMNA P02545 3/20 0.36
HPGD P15428 3/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 3/20 0.33
GLA P06280 1/20 0.33
MAPT P10636 3/20 0.32
MAPK1 P28482 1/20 0.32
TP53 P04637 1/20 0.32
ADORA1 P30542 1/20 0.32
HTT P42858 1/20 0.32
PDE4B Q07343 1/20 0.31
PDE4D Q08499 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
SCHEMBL1317017 0.92 ALDH1A1 (0.50) ALDH1A1TDP1ALOX15TSHRNFKB1
SCHEMBL7400206 0.86 ALDH1A1 (0.41) ALDH1A1TDP1ALOX15TSHRLMNA
SCHEMBL7523521 0.80 LMNA (0.44) ALDH1A1TDP1LMNAHPGDMEN1
SCHEMBL13500216 0.77 LMNA (0.34) ALDH1A1ALOX15TSHRLMNA
SCHEMBL13934337 0.75 NFKB1 (0.68) NFKB1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL8220440 0.75 HRH4 (0.43) ALDH1A1TDP1ALOX15TSHRLMNA
SCHEMBL17576118 0.75 LMNA (0.38) ALDH1A1ALOX15TSHRLMNA
SCHEMBL25685713 0.75 LMNA (0.33) ALDH1A1ALOX15TSHRLMNA
SCHEMBL11543019 0.72 HTT (0.33) LMNAKMT2AMAPTHTT
SCHEMBL7399881 0.72 PDE4A (0.52) TDP1LMNAKMT2ASMN1; SMN2MAPT

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
EP-0380017-A2 A process for the preparation of triazinic polymers HIMONT ITALIA S.r.l. (IT) 1990-08-01 EP claimed
EP-0380017-A2 A process for the preparation of triazinic polymers HIMONT ITALIA S.r.l. (IT) 1990-08-01 EP disclosed