SCHEMBL20564663

SCHEMBL20564663

CC(C)[Si](OCc1ncc[nH]1)(C(C)C)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 12/20 0.46
HTR1A P08908 1/20 0.40
ALOX15 P16050 1/20 0.39
TXN P10599 1/20 0.38
TXNRD1 Q16881 1/20 0.38
TERT O14746 1/20 0.36
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL22471169 0.82 TAAR1 (0.44) TAAR1HTR1AALOX15TXNTXNRD1
SCHEMBL22471008 0.80 TBXAS1 (0.43) TAAR1HTR1AALOX15TXNTXNRD1
SCHEMBL28547937 0.78 TBXAS1 (0.45) TAAR1HTR1AALOX15TXNTXNRD1
SCHEMBL12590300 0.77 TAAR1 (0.45) TAAR1HTR1AALOX15TXNTXNRD1
SCHEMBL27034035 0.76 TAAR1 (0.41) TAAR1HTR1AALOX15TXNTXNRD1
SCHEMBL7270060 0.74 TAAR1 (0.42) TAAR1HTR1AALOX15TXNTXNRD1
SCHEMBL585992 0.74
SCHEMBL11224676 0.73 ALOX15 (0.48) TAAR1HTR1AALOX15TERTALDH1A1
SCHEMBL25996725 0.73 TAAR1 (0.46) TAAR1HTR1AALOX15TXNTXNRD1
SCHEMBL8832585 0.73 ALOX15 (0.38) TAAR1HTR1AALOX15TERTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190135793-A1 HETEROCYCLIC INHIBITORS OF KDM5 FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-05-09 US disclosed
WO-2018213777-A1 HETEROCYCLIC INHIBITORS OF KDM5 FOR THE TREATMENT OF DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2018-11-22 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-20190135793-A1 HETEROCYCLIC INHIBITORS OF KDM5 FOR THE TREATMENT OF DISEASE KDM5A, KDM5B, KDM5C TAAR1 4233/4885HTR1A 3240/4885ALOX15 2975/4885

“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.