SCHEMBL5770518

SCHEMBL5770518

CC(C)(C)[Si](C)(C)OC1CNC(c2ccccc2Cl)C1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.35
HTR2A P28223 1/20 0.35
HTR2B P41595 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 1/20 0.32
SLC6A3 Q01959 2/20 0.32
MAPT P10636 2/20 0.32
TAAR1 Q96RJ0 1/20 0.31
ALDH1A1 P00352 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MAPK1 P28482 1/20 0.31
SLC6A2 P23975 2/20 0.31
TP53 P04637 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30
BUB1 O43683 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
SCHEMBL5770521 1.00 HTR2C (0.35) HTR2CHTR2AHTR2BSMN1; SMN2GAA
SCHEMBL5770510 1.00 HTR2C (0.35) HTR2CHTR2AHTR2BSMN1; SMN2GAA
SCHEMBL30078361 0.82
SCHEMBL17870944 0.81 BUB1 (0.34) HTR2BSLC6A3ALDH1A1SLC6A2MEN1
SCHEMBL19512616 0.81 BUB1 (0.34) HTR2BSLC6A3ALDH1A1SLC6A2MEN1
SCHEMBL2912280 0.81 BUB1 (0.34) HTR2BSLC6A3ALDH1A1SLC6A2MEN1
SCHEMBL17514153 0.78 CHRNA7 (0.33) GAASLC6A3MAPTMAPK1SLC6A2
SCHEMBL16309084 0.74 KDM1A (0.36) HTR2CHTR2AHTR2B
SCHEMBL20220410 0.74 KDM1A (0.36) HTR2CHTR2AHTR2B
Hydrochloric Acid SCHEMBL15017029 0.73 KDM1A (0.35) HTR2CHTR2AHTR2B

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-20060160794-A1 Tachykinin receptor antagonists ELI LILLY AND COMPANY 2006-07-20 US disclosed
EP-1638944-A1 TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-03-29 EP disclosed
WO-2005000821-A1 TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-01-06 WO 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-20060160794-A1 Tachykinin receptor antagonists TACR1, TACR2, PROKR1 HTR2C 948/4885HTR2A 719/4885HTR2B 761/4885

“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.