SCHEMBL13232452

SCHEMBL13232452

Cc1ccc(-c2ccccc2-c2nnnn2[Si](C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
TSHR P16473 2/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
HPGD P15428 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KCNN4 O15554 2/20 0.36
PTGS2 P35354 2/20 0.36
HPGDS O60760 1/20 0.36

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
SCHEMBL12748014 0.79 AGTR1 (0.46) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL7647188 0.75 POLB (0.41) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL7265697 0.75 ALDH1A1 (0.40) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL8036362 0.73 LMNA (0.50) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL6360839 0.72 P2RX7 (0.62) ALDH1A1KMT2ANPSR1
SCHEMBL30956037 0.72 AGTR1 (0.51) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL635 0.72 AGTR1 (0.51) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2
SCHEMBL4782108 0.70 ALDH1A1 (0.42) ALDH1A1TSHRPOLBKCNN4
SCHEMBL13232455 0.69 TSHR (0.43) ALDH1A1TSHRKMT2APOLB
SCHEMBL3294988 0.69 LMNA (0.53) ALDH1A1TSHRNPC1RAB9ASMN1; SMN2

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-8563586-B2 1,(3,)5-substituted imidazoles, their use in the treatment of hypertension and methods for their preparation ELDRUG S.A. (GR) 2013-10-22 US disclosed
US-8563586-B2 1,(3,)5-substituted imidazoles, their use in the treatment of hypertension and methods for their preparation ELDRUG S.A. (GR) 2013-10-22 US disclosed
US-20100166837-A1 1,(3,)5-SUBSTITUTED IMIDAZOLES, THEIR USE IN THE TREATMENT OF HYPERTENSION AND METHODS FOR THEIR PREPARATION ELDRUG S.A. (GR) 2010-07-01 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-20100166837-A1 1,(3,)5-SUBSTITUTED IMIDAZOLES, THEIR USE IN THE TREATMENT OF HYPERTENSION AND METHODS FOR THEIR PREPARATION AGTR1, AGTR2, AGT ALDH1A1 775/4885TSHR 455/4885NPC1 639/4885

“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.