SCHEMBL2687231

SCHEMBL2687231

Cl[Si](Cl)(Cl)Cc1ccc(-c2ccc(C[Si](Cl)(Cl)Cl)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.41
HRH4 Q9H3N8 2/20 0.36
TAAR1 Q96RJ0 2/20 0.35
MAOB P27338 2/20 0.34
CYP17A1 P05093 2/20 0.33
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
ESR1 P03372 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP19A1 P11511 1/20 0.33
LSS P48449 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
CYP2A6 P11509 1/20 0.31
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31

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
SCHEMBL4450244 0.91 ESR1 (0.38) ESR1
SCHEMBL5494552 0.90 TAAR1 (0.50) TAAR1CYP17A1CYP11B1CYP11B2CYP3A4
SCHEMBL2686016 0.84 HRH3 (0.31) HRH3
SCHEMBL7557619 0.80 CA1 (0.39) ESR1
SCHEMBL1479279 0.80 IDO1 (0.48) TAAR1MAOBCYP11B1CYP11B2CYP19A1
SCHEMBL5552238 0.78 ESR1 (0.31) ESR1
SCHEMBL2684489 0.78 IDO1 (0.46) TAAR1MAOBCYP11B1CYP11B2CYP19A1
SCHEMBL5485087 0.78 TAAR1 (0.42) HRH3TAAR1CYP11B1CYP11B2CYP19A1
SCHEMBL242725 0.77 CALM1 (0.45) TAAR1MAOBCYP3A4CYP19A1CYP2D6
SCHEMBL297636 0.72 IDO1 (0.52) TAAR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120114544-A1 ORGANIC CHLOROHYDROSILANE AND METHOD FOR PREPARING THEM SAMSUNG FINE CHEMICALS CO., LTD (KR) 2012-05-10 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-20120114544-A1 ORGANIC CHLOROHYDROSILANE AND METHOD FOR PREPARING THEM PHPT1, SIK1, SIK2 HRH3 103/4885HRH4 214/4885TAAR1 4222/4885

“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.