Benzene

Benzene

SCHEMBL4580264

C.C.C.N#CO.N#CO.c1ccccc1.c1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
CA5A P35218 1/20 0.60
CA9 Q16790 1/20 0.60
CA5B Q9Y2D0 1/20 0.60
TSHR P16473 3/20 0.33
TP53 P04637 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
Benzene SCHEMBL29278073 1.00 CA1 (0.60) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL29278074 1.00 CA1 (0.60) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL8509776 1.00 CA1 (0.60) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL891549 1.00 CA1 (0.60) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL4656395 0.95 CA1 (0.67) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL2058556 0.95 CA1 (0.67) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL4655504 0.95 CA1 (0.67) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL27502496 0.95
Benzene SCHEMBL28747913 0.90 CA1 (0.60) CA1CA2CA5ACA9CA5B
Benzene SCHEMBL7059911 0.90 CA1 (0.60) CA1CA2CA5ACA9CA5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242035-B2 Flame-resistant, low-temperature curing cyanate-based prepreg resins for honeycomb sandwich components with excellent surfaces Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2012-08-14 US disclosed
US-20120135217-A1 Hybrid Polymers from Cyanates and Silazanes, Process for Their Production and Use CLARIANT INTERNATIONAL, LTD. (CH) 2012-05-31 US disclosed
US-20080032089-A1 Flame-Resistant, Low-Temperature Curing Cyanate-Based Prepreg Resins for Honeycomb Sandwich Components with Excellent Surfaces FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2008-02-07 US disclosed