Benzene

Benzene

SCHEMBL3154012

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

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.56
LMNA P02545 3/20 0.53
GAA P10253 3/20 0.53
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.53
HSP90AA1 P07900 1/20 0.53
HSD17B10 Q99714 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
POLB P06746 2/20 0.48
PKM P14618 1/20 0.48
KMT2A Q03164 3/20 0.48
GSTP1 P09211 1/20 0.47
MEN1 O00255 2/20 0.45
ESR1 P03372 1/20 0.45
PGR P06401 1/20 0.45
CHRM2 P08172 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
AR P10275 1/20 0.45

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
SCHEMBL80532 0.96 LMNA (0.57) ELANELMNAGAAMAPTALDH1A1
SCHEMBL1395475 0.86 CA1 (0.47) ELANELMNAGAAHSD17B10RAB9A
SCHEMBL28188938 0.83 LMNA (0.47) ELANELMNAGAAMAPTALDH1A1
SCHEMBL4113624 0.81 AKT1 (0.55) ELANELMNAGAAMAPTALDH1A1
SCHEMBL531085 0.81 ELANE (0.61) ELANELMNAGAAMAPTALDH1A1
SCHEMBL717987 0.81 NPC1 (0.65) ELANELMNAGAAMAPTALDH1A1
SCHEMBL29223162 0.80 KMT2A (0.41) ELANELMNAGAAMAPTALDH1A1
SCHEMBL777803 0.79 ELANE (0.62) ELANELMNAGAAMAPTALDH1A1
SCHEMBL609104 0.79 CA1 (0.48) ELANELMNAMAPTALDH1A1HSD17B10
SCHEMBL9081470 0.79 LMNA (0.61) ELANELMNAGAAMAPTALDH1A1

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 ELANE 290/4885LMNA 2113/4885GAA 1982/4885

“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.