SCHEMBL2810259

SCHEMBL2810259

C[Si](C)(C)C#Cc1cccc2c1C(=O)OC2=O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.39
ALOX15 P16050 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TYMS P04818 3/20 0.37
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL12814518 0.85 TDP1 (0.48) ALOX15TDP1TYMSKDM4EALDH1A1
SCHEMBL2710468 0.82 ALOX15 (0.41) ALOX15TDP1TYMSALDH1A1MAPT
SCHEMBL29269175 0.78 MAPT (0.45) CREBBPALOX15TDP1KDM4EMEN1
SCHEMBL2811769 0.78 ALOX15 (0.38) ALOX15TDP1TYMS
SCHEMBL29012271 0.78 ALOX15 (0.38) ALOX15TDP1TYMS
SCHEMBL2808745 0.78 ALOX15 (0.38) ALOX15TDP1TYMSALDH1A1TSHR
SCHEMBL2812659 0.76 GRM5 (0.43) ALOX15TDP1CYP1A2
SCHEMBL29546502 0.76 ALOX15 (0.43) ALOX15TDP1TYMSKDM4EMEN1
SCHEMBL108548 0.76 ALOX15 (0.43) ALOX15TDP1TYMSKDM4EMEN1
SCHEMBL20791596 0.76 MAPT (0.40) CREBBPKDM4EMEN1ALDH1A1CYP1A2

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-20100240908-A1 ACETYLENE COMPOUND FUJIFILM CORPORATION (JP) 2010-09-23 US disclosed
EP-2202221-A1 ACETYLENE COMPOUND Fujifilm Corporation (JP) 2010-06-30 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-20100240908-A1 ACETYLENE COMPOUND NAT1, KATNA1, KAT2B CREBBP 2095/4885ALOX15 1994/4885TDP1 4533/4885

“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.