Benzene

Benzene

SCHEMBL31572091

[Ni+2].c1ccccc1.c1ccccc1

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.75
TP53 P04637 1/20 0.75
ALDH1A1 P00352 1/20 0.30
NAPRT Q6XQN6 1/20 0.30
TDP1 Q9NUW8 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 SCHEMBL194 0.87
SCHEMBL1086976 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1
Benzene SCHEMBL1330958 0.87
Benzene SCHEMBL8022649 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1
Benzene SCHEMBL8021516 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1
Benzene SCHEMBL8107103 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1
Benzene SCHEMBL8576855 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1
Benzene SCHEMBL8430159 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1
SCHEMBL1112772 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1
Benzene SCHEMBL10780001 0.87 TSHR (1.00) TSHRTP53ALDH1A1NAPRTTDP1

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-20250149635-A1 SILICATE PLATFORM AS WEAKLY-COORDINATING ANIONS FOR DIVERSE ORGANOMETALLIC TRANSFORMATIONS AND ELECTROCHEMICAL APPLICATIONS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2025-05-08 US 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-20250149635-A1 SILICATE PLATFORM AS WEAKLY-COORDINATING ANIONS FOR DIVERSE ORGANOMETALLIC TRANSFORMATIONS AND ELECTROCHEMICAL APPLICATIONS CPNE4, HCN2, METTL14 TSHR 4299/4885TP53 2449/4885ALDH1A1 4433/4885

“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.