SCHEMBL6054716

SCHEMBL6054716

Cc1cccc(N(C)[SiH3])c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.41
ATM Q13315 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
MAPT P10636 2/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2A6 P11509 1/20 0.36
TSHR P16473 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPK1 P28482 1/20 0.35
ACHE P22303 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
KEAP1 Q14145 1/20 0.32

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
Hydrochloric Acid SCHEMBL27745837 0.98 TRPA1 (0.39) TRPA1ATMCA1CA2CA7
SCHEMBL30733276 0.80 MAPT (0.48) TRPA1ATMCA1CA2CA7
SCHEMBL1911943 0.80 MAPT (0.48) TRPA1ATMCA1CA2CA7
SCHEMBL5436537 0.80 TRPA1 (0.44) TRPA1ATMCA1CA2CA7
SCHEMBL8280381 0.80 ACHE (0.45) CA1CA2CA7CA9ALDH1A1
SCHEMBL16860015 0.78 MAPT (0.46) TRPA1ATMCA1CA2CA7
Hydrochloric Acid SCHEMBL2861142 0.78 MAPT (0.46) TRPA1ATMCA1CA2CA7
SCHEMBL585558 0.77 TRPA1 (0.46) TRPA1ATMCA1CA2CA7
SCHEMBL11181553 0.76 TRPA1 (0.41) TRPA1ATMCA1CA2CA7
SCHEMBL5164312 0.76 ALDH1A1 (0.37) TRPA1ATMCA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7045644-B2 Imidochromium compounds in catalyst systems for olefin polymerization BASELL POLYOLEFINE GMBH (DE) 2006-05-16 US disclosed
US-20040214970-A1 Imidochromium compounds in catalyst systems for olefin polymerization EQUISTAR CHEMICALS, LP 2004-10-28 US disclosed
US-6784261-B1 OBTAINED BY A PROCESS ENCOMPASSING THE FOLLOWING PROCESS STEPS: CONTACTING A DIOXOCHROMIUM COMPOUND WITH AN N-SULFINYL COMPOUND, CONTACTING THE REACTION PRODUCT THUS OBTAINED WITH CHLORINE, AT LEAST ONE ACTIVATOR COMPOUND BASELL POLYOLEFINE GMBH (DE) 2004-08-31 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-20040214970-A1 Imidochromium compounds in catalyst systems for olefin polymerization HCCS, PPOX, INF2 TRPA1 1613/4885ATM 3921/4885CA1 4065/4885

“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.