SCHEMBL4238157

SCHEMBL4238157

C=Cc1ccc(C=C)cc1.C[SiH2]C

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.73
TSHR P16473 1/20 0.53
HDAC8 Q9BY41 3/20 0.50
TDP1 Q9NUW8 2/20 0.44
TP53 P04637 1/20 0.40
TRPA1 O75762 1/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38
CHRNA4 P43681 1/20 0.38
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL7639 0.86 ALDH1A1 (1.00) ALDH1A1TSHRHDAC8TDP1TP53
SCHEMBL473081 0.86 ALDH1A1 (1.00) ALDH1A1TSHRHDAC8TDP1TP53
SCHEMBL8165840 0.83 ALDH1A1 (0.58) ALDH1A1TSHRHDAC8TDP1TP53
Methyl Alcohol SCHEMBL28639806 0.83 ALDH1A1 (0.79) ALDH1A1TSHRHDAC8TDP1TP53
Hydrochloric Acid SCHEMBL23581954 0.82 ALDH1A1 (0.92) ALDH1A1TSHRHDAC8TDP1TP53
Water SCHEMBL20378930 0.82 ALDH1A1 (0.92) ALDH1A1TSHRHDAC8TDP1TP53
SCHEMBL22496003 0.82 ALDH1A1 (0.92) ALDH1A1TSHRHDAC8TDP1TP53
Water SCHEMBL28759143 0.82 ALDH1A1 (0.92) ALDH1A1TSHRHDAC8TDP1TP53
Ethylene SCHEMBL7955374 0.82 ALDH1A1 (0.92) ALDH1A1TSHRHDAC8TDP1TP53
SCHEMBL6935569 0.82 ALDH1A1 (0.92) ALDH1A1TSHRHDAC8TDP1TP53

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
EP-2110118-B1 Malodour reducing composition and uses thereof TAKASAGO PERFUMERY CO LTD (JP) 2014-11-19 EP disclosed
EP-2110118-A1 Malodour reducing composition and uses thereof Takasago International Corporation (JP) 2009-10-21 EP disclosed
US-20090257973-A1 MALODOR REDUCING COMPOSITION, FRAGRANCE COMPOSITION AND PRODUCT COMPRISING THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-15 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-20090257973-A1 MALODOR REDUCING COMPOSITION, FRAGRANCE COMPOSITION AND PRODUCT COMPRISING THE SAME AKR1C4, AKR1C3, AKR1C1 ALDH1A1 144/4885TSHR 4407/4885HDAC8 4048/4885

“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.