Benzene

Benzene

SCHEMBL3155393

CC(=O)Oc1ccc(C=O)cc1.c1ccccc1

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.59
ELANE P08246 1/20 0.58
MAPT P10636 5/20 0.58
LMNA P02545 4/20 0.58
KDM4E B2RXH2 4/20 0.58
MEN1 O00255 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
TTR P02766 1/20 0.58
TP53 P04637 1/20 0.58
CYP3A4 P08684 1/20 0.58
ALDH1A1 P00352 5/20 0.55
GAA P10253 2/20 0.55
HSP90AA1 P07900 1/20 0.55
CYP2A6 P11509 1/20 0.52
HSD17B10 Q99714 1/20 0.52
POLB P06746 1/20 0.50
PKM P14618 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
TUBB4A P04350 1/20 0.49
TUBB P07437 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
SCHEMBL203500 0.96 KMT2A (0.61) KMT2AELANEMAPTLMNAKDM4E
SCHEMBL6790494 0.90 HSD17B10 (0.59) KMT2AELANEMAPTLMNAKDM4E
SCHEMBL7013877 0.89 ELANE (0.65) KMT2AELANEMAPTLMNAKDM4E
4-Hydroxybenzaldehyde SCHEMBL9418057 0.89 ALDH5A1 (0.59) KMT2AELANEMAPTLMNAKDM4E
SCHEMBL8009088 0.85 ALDH1A1 (0.58) KMT2AELANEMAPTLMNAKDM4E
SCHEMBL6243024 0.85 KMT2A (0.60) KMT2AMAPTLMNAKDM4EMEN1
SCHEMBL716755 0.82 KMT2A (0.71) KMT2AELANEMAPTLMNAKDM4E
SCHEMBL716756 0.82 KMT2A (0.71) KMT2AELANEMAPTLMNAKDM4E
SCHEMBL9669873 0.82 ELANE (0.61) KMT2AELANEMAPTLMNAKDM4E
Benzene SCHEMBL27858176 0.82 ELANE (0.56) KMT2AELANEMAPTLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154123-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2013-10-23 EP disclosed
US-7851659-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-14 US disclosed
US-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 US disclosed
EP-2154123-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-17 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-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, NQO2, NDUFC2 KMT2A 548/4885ELANE 290/4885MAPT 4606/4885

“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.