Sugi Predict

Sugi Predict / Compounds / Benzene

Benzene

Benzene

SCHEMBL11575906

NC(=O)CNC(=O)C(N)Cc1ccc(O)cc1.c1ccccc1

nearest known ligand 0.69

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.58
▸ OPRD1 P41143 8/20 0.54
▸ OPRM1 P35372 4/20 0.54
▸ OPRK1 P41145 1/20 0.54
▸ MMP2 P08253 1/20 0.51
▸ YARS1 P54577 2/20 0.49
▸ ERAP2 Q6P179 1/20 0.49
▸ LNPEP Q9UIQ6 1/20 0.49

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 SCHEMBL11575909 1.00 SLC7A5 (0.58) SLC7A5OPRD1OPRM1OPRK1MMP2
SCHEMBL9438025 0.97 SLC7A5 (0.57) SLC7A5OPRD1OPRM1OPRK1MMP2
SCHEMBL9157903 0.97 SLC7A5 (0.57) SLC7A5OPRD1OPRM1OPRK1MMP2
SCHEMBL8788898 0.89 ALPI (0.58) SLC7A5MMP2
SCHEMBL8789703 0.89 ALPI (0.58) SLC7A5MMP2
SCHEMBL14963151 0.89 ALPI (0.58) SLC7A5MMP2
SCHEMBL4407092 0.88 SLC7A5 (0.62) SLC7A5OPRD1OPRM1OPRK1MMP2
SCHEMBL4409294 0.88 SLC7A5 (0.62) SLC7A5OPRD1OPRM1OPRK1MMP2
SCHEMBL6047681 0.88 SLC7A5 (0.62) SLC7A5OPRD1OPRM1OPRK1MMP2
SCHEMBL26605058 0.84 ALPI (0.51) SLC7A5OPRD1OPRM1OPRK1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4086136-A Process for producing a peptide using a serine or thiol proteinase (ZAIDANHOJIN) SAGAMI CHEMICAL RESEARCH CENTER (JA) 1978-04-25 — — US disclosed