SCHEMBL15022981

SCHEMBL15022981

C[Si](C)(C)C#Cc1ccc(-c2n[nH]cc2-c2ccncc2)cn1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.33
NTRK1 P04629 4/20 0.31
KIT P10721 1/20 0.31
PIK3CA P42336 1/20 0.31
MAPK9 P45984 1/20 0.30
MAPK10 P53779 1/20 0.30
MAPK1 P28482 1/20 0.30
KDR P35968 2/20 0.30
BMP4 P12644 1/20 0.30
FLT1 P17948 1/20 0.30
FLT4 P35916 1/20 0.30
BRAF P15056 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
SCHEMBL15022991 0.82 NTRK1 (0.33) SLC2A1NTRK1KITPIK3CAMAPK9
SCHEMBL15022061 0.82 PDE10A (0.36) MAPK9MAPK10MAPK1BRAF
SCHEMBL15022089 0.82 PDE10A (0.36) MAPK9MAPK10MAPK1BRAF
SCHEMBL15022078 0.79 GRM5 (0.48) MAPK9MAPK10
SCHEMBL15022345 0.77 MAPK13 (0.53) MAPK1BRAF
SCHEMBL15023019 0.76 CYP19A1 (0.43) SLC2A1NTRK1KITPIK3CAMAPK9
SCHEMBL5451902 0.72 IMPDH2 (0.44) MAPK9MAPK10MAPK1BRAF
SCHEMBL22531721 0.72 BACE1 (0.40)
SCHEMBL29471995 0.72 BACE1 (0.40)
SCHEMBL22258789 0.71 CHEK1 (0.41) PIK3CA

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-20130158031-A1 ALKYNE-BRIDGED HETERO-AROMATICS AND USES THEREOF SU ZHOU JING HONG BIOTECH CO., LTD. (CN) 2013-06-20 US disclosed
US-20130158031-A1 ALKYNE-BRIDGED HETERO-AROMATICS AND USES THEREOF SU ZHOU JING HONG BIOTECH CO., LTD. (CN) 2013-06-20 US disclosed
US-20130158031-A1 ALKYNE-BRIDGED HETERO-AROMATICS AND USES THEREOF SU ZHOU JING HONG BIOTECH CO., LTD. (CN) 2013-06-20 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-20130158031-A1 ALKYNE-BRIDGED HETERO-AROMATICS AND USES THEREOF CHRNA10, ATXN10, SCN10A SLC2A1 1125/4885NTRK1 1609/4885KIT 4836/4885

“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.