SCHEMBL4271978

SCHEMBL4271978

CC(C)(C)[Si](C)(C)Oc1ccc(C=C(Br)Br)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PREP P48147 4/20 0.41
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA9 Q16790 4/20 0.40
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
APEX1 P27695 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NQO2 P16083 1/20 0.31
PTGS1 P23219 1/20 0.31

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
SCHEMBL7721195 0.82 TBXAS1 (0.42) PREPCA12CA1CA9HSP90AA1
SCHEMBL7721192 0.82 TBXAS1 (0.42) PREPCA12CA1CA9HSP90AA1
SCHEMBL7189378 0.81 CA12 (0.46) PREPCA12CA1CA9KDM4E
SCHEMBL4261450 0.80 PREP (0.38) PREPCA12CA1CA9KDM4E
SCHEMBL4261447 0.80 PREP (0.38) PREPCA12CA1CA9KDM4E
SCHEMBL6763899 0.80 PREP (0.53) PREPCA12CA1CA9KDM4E
SCHEMBL4024641 0.79 KMT2A (0.49) PREPCA12CA1CA9KDM4E
SCHEMBL4024645 0.79 KMT2A (0.49) PREPCA12CA1CA9KDM4E
SCHEMBL896879 0.78 ALDH1A1 (0.50) PREPCA12CA1CA9KDM4E
SCHEMBL37002 0.78 PREP (0.43) PREPCA12CA1CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595415-B2 α-Substituted vinyltin compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-09-29 US disclosed
US-20090023939-A1 ALPHA-SUBSTITUTED VINYLTIN COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-01-22 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-20090023939-A1 ALPHA-SUBSTITUTED VINYLTIN COMPOUND TST, CCNT1, TMT1A PREP 4545/4885CA12 2473/4885CA1 2218/4885

“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.