SCHEMBL176708

SCHEMBL176708

CC[Si](CC)(CC)OC(CN(CCO)Cc1ccccc1)c1cccc(N(Cc2ccccc2)S(C)(=O)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.41
TSHR P16473 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 3/20 0.38
POLB P06746 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
ACHE P22303 1/20 0.36
GAA P10253 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35

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
SCHEMBL176707 1.00 GRM2 (0.41) GRM2TSHRHSD17B10MEN1KMT2A
SCHEMBL7531295 0.83 GRM2 (0.46) GRM2MEN1KMT2AALDH1A1POLB
SCHEMBL7531291 0.83 GRM2 (0.46) GRM2MEN1KMT2AALDH1A1POLB
SCHEMBL7530130 0.82 GRM2 (0.44) GRM2TSHRMEN1KMT2AALDH1A1
SCHEMBL5196623 0.82 GRM2 (0.44) GRM2TSHRMEN1KMT2AALDH1A1
SCHEMBL178153 0.79 HTT (0.40) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL178182 0.79 KCNH2 (0.36) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL176926 0.78 HTT (0.40) MEN1KMT2A
SCHEMBL177159 0.78 KCNH2 (0.43)
SCHEMBL176925 0.78 HTT (0.40) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304443-B2 Indazole derivatives ASAHI KASEI PHARMA CORPORATION (JP) 2012-11-06 US disclosed
US-8008506-B2 Indazole compounds ASAHI KASEI PHARMA CORPORATION (JP) 2011-08-30 US disclosed
EP-2345644-A1 INDAZOLE COMPOUND Asahi Kasei Pharma Corporation (JP) 2011-07-20 EP disclosed
US-20100160256-A1 INDAZOLE COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2010-06-24 US disclosed
US-20100152265-A1 INDAZOLE DERIVATIVES ASAHI KASEI PHARMA CORPORATION (JP) 2010-06-17 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 (2 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-20100152265-A1 INDAZOLE DERIVATIVES ADRB3, INSR, ADRB1 GRM2 2860/4885TSHR 426/4885HSD17B10 363/4885
US-20100160256-A1 INDAZOLE COMPOUNDS GPR119, ADRB1, ADRA1A GRM2 1395/4885TSHR 237/4885HSD17B10 473/4885

“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.