Benzene

Benzene

SCHEMBL19639971

CC(NC(=O)c1c(-c2ccnn2-c2ccc(C#N)cc2)n(C)n(-c2cccc(C(F)(F)F)c2)c1=O)C(=O)N(C)CC[N+](C)(C)C.c1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.48
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CTSK P43235 2/20 0.35
KLRK1 P26718 1/20 0.34
MICA Q29983 1/20 0.34
RAET1L Q5VY80 1/20 0.34

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
SCHEMBL21796105 0.99 ELANE (0.49) ELANEMEN1KMT2ACTSKKLRK1
SCHEMBL19656274 0.92 ELANE (0.49) ELANEMEN1KMT2ACTSKKLRK1
SCHEMBL19656260 0.88 ELANE (0.49) ELANEMEN1KMT2ACTSK
SCHEMBL19656244 0.87 ELANE (0.47) ELANEMEN1KMT2ACTSKKLRK1
SCHEMBL19656237 0.86 ELANE (0.46) ELANEMEN1KMT2A
Benzene SCHEMBL19639991 0.86 ELANE (0.54) ELANEMEN1KMT2ACTSK
Benzene SCHEMBL19640006 0.86 ELANE (0.46) ELANEMEN1KMT2ACTSK
Benzene SCHEMBL19639974 0.85 ELANE (0.44) ELANEMEN1KMT2A
SCHEMBL21796119 0.85 ELANE (0.54) ELANEMEN1KMT2ACTSK
SCHEMBL19640027 0.85 ELANE (0.47) ELANEMEN1KMT2ACTSK

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
US-20170340611-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US claimed
EP-3464268-B1 NOVEL COMPOUNDS CHIESI FARM SPA (IT) 2020-03-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170340611-A1 NOVEL COMPOUNDS SERPINB1, ELANE, MPO ELANE 2/4885MEN1 4540/4885KMT2A 4327/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.