Benzene

Benzene

SCHEMBL5134281

O=C1c2ccccc2C(=O)c2c(S)cccc21.c1ccccc1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.57
ALDH1A1 P00352 7/20 0.57
L3MBTL1 Q9Y468 4/20 0.57
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
CDC25B P30305 1/20 0.55
MAPT P10636 9/20 0.52
MAPK1 P28482 7/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
LMNA P02545 4/20 0.52
EGFR P00533 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
RAB9A P51151 2/20 0.52
NSD2 O96028 2/20 0.52
PABPC1 P11940 1/20 0.52
MAOA P21397 7/20 0.48
RECQL P46063 3/20 0.48
KDM4E B2RXH2 3/20 0.48
ALOX12 P18054 2/20 0.48
MAOB P27338 1/20 0.48

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
SCHEMBL1886170 0.98 ADORA2A (0.59) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL5543173 0.93 MAOA (0.52) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL3062545 0.91 MAPT (0.54) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
Propane SCHEMBL10719548 0.90 ADORA2A (0.52) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL2076578 0.88 MEN1 (0.57) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL18143565 0.88 MAPT (0.55) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL11537772 0.86 L3MBTL1 (0.44) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL5854205 0.82 MEN1 (0.46) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL26802763 0.81 ADORA2A (0.42) ADORA2AALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL26802562 0.81 ALDH1A1 (0.50) ADORA2AALDH1A1L3MBTL1MAPTMAPK1

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
US-20230312922-A1 POLYAMIDE MOLDING MATERIAL WITH HIGH FRACTURE STRENGTH AND MOLDED PARTS PRODUCED THEREFROM EMS-CHEMIE AG (CH) 2023-10-05 US disclosed
CN-101636453-B Transparent colourants and colourant compositions, and their use BASF SE 2014-03-26 CN disclosed
US-7384576-B1 Lead-free mixture as a radiation protection additive LANXESS DEUTSCHLAND GMBH (DE) 2008-06-10 US disclosed
US-20080128658-A1 LEAD-FREE MIXTURE AS A RADIATION PROTECTION ADDITIVE LANXESS DEUTSCHLAND GMBH (DE) 2008-06-05 US disclosed
US-7166669-B2 Dark-colored thermoplastic molding compositions and molded parts which in the wavelength region from 700-1200 nm are laser-transmitting and can be welded to laser-absorbing molded parts by means of laser transmission welding BAYER AKTIENGESELLSCHAFT (DE) 2007-01-23 US disclosed
US-20030125429-A1 Dark-colored thermoplastic molding compositions and molded parts which in the wavelength region from 700-1200 nm are laser-transmitting and can be welded to laser-absorbing molded parts by means of laser transmission welding ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2003-07-03 US disclosed