Benzene

Benzene

SCHEMBL6907964

OC(O)COCC(O)O.c1ccccc1

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
CHRNA7 P36544 1/20 0.30

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
SCHEMBL543942 0.89
Phenol SCHEMBL7771952 0.82 CA1 (0.52) CA1CA2CA7CA9LMNA
Ethylene Glycol SCHEMBL29291016 0.79 TSHR (0.36) KDM4E
Hydroquinone SCHEMBL218793 0.76 HIF1A (0.44) CA1CA2CA9LMNAALDH1A1
SCHEMBL881543 0.74 HSD17B10 (0.41)
SCHEMBL7919977 0.71 HSD17B10 (0.39)
SCHEMBL19642809 0.71 USP2 (0.46) CA1CA2CA7LMNAALDH1A1
Benzene SCHEMBL502623 0.71 USP2 (0.46) CA1CA2CA7CA9LMNA
SCHEMBL22828619 0.69
SCHEMBL18017628 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106280325-B A kind of polylactide type polyurethane polydactyl acid alloy and preparation method thereof 中国科学院宁波材料技术与工程研究所 2018-05-29 CN claimed
CN-106280325-A A kind of polylactide type polyurethane polydactyl acid alloy and preparation method thereof 中国科学院宁波材料技术与工程研究所 2017-01-04 CN claimed
CN-106280325-B A kind of polylactide type polyurethane polydactyl acid alloy and preparation method thereof 中国科学院宁波材料技术与工程研究所 2018-05-29 CN disclosed
CN-106280325-A A kind of polylactide type polyurethane polydactyl acid alloy and preparation method thereof 中国科学院宁波材料技术与工程研究所 2017-01-04 CN disclosed
EP-0891999-B1 Air bag made of silicone modified thermoplastic polyurethane resin TAKATA CORP (JP) 2004-03-17 EP disclosed
US-6444596-B1 AIR BAG COMPRISING BASE CLOTH FORMED OF WOVEN FABRIC AND SILICONE MODIFIED THERMOPLASTIC POLYURETHANE RESIN FILM CONTAINING POLYSILOXANE SEGMENT FITTED ON SURFACE OF WOVEN FABRIC TAKATA CORPORATION (JP) 2002-09-03 US disclosed
US-5945185-A POLYSILOXANEURETHANE COPOLYMERS FOR PROTECTIVE DEVICES TAKATA CORPORATION (JP) 1999-08-31 US disclosed
EP-0891999-A1 Air bag made of silicone modified thermoplastic polyurethane resin TAKATA CORPORATION (JP) 1999-01-20 EP disclosed