SCHEMBL13508322

SCHEMBL13508322

Cc1ncc(CC(C)(C)C)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.56
HRH4 Q9H3N8 2/20 0.55
HRH1 P35367 1/20 0.55
BRS3 P32247 9/20 0.38
KCNH2 Q12809 2/20 0.38
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
BAZ2B Q9UIF8 1/20 0.35
CYP2A6 P11509 1/20 0.32
TSHR P16473 1/20 0.32
NUDT1 P36639 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
SCHEMBL2708549 0.79 HRH4 (0.67) FDPSHRH4HRH1BAZ2BCYP2A6
SCHEMBL21324881 0.78 BRS3 (0.49) BRS3KCNH2
SCHEMBL889370 0.75
SCHEMBL889023 0.73
SCHEMBL889085 0.73
SCHEMBL906338 0.73
SCHEMBL21350694 0.72 BRS3 (0.44) FDPSBRS3KCNH2TSHR
SCHEMBL889061 0.71
Hydrochloric Acid SCHEMBL3583087 0.71
2-Methylhistamine SCHEMBL889086 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9149463-B2 Methods and compositions of treating a Flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANDFORD JUNIOR UNIVERSITY (US) 2015-10-06 US disclosed
US-9101628-B2 Methods and composition of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2015-08-11 US disclosed
US-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-02-04 US disclosed
US-20100015093-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-01-21 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-20100015093-A1 Methods and compositions of treating a flaviviridae family viral infection EIF2AK2, NSUN3, NSUN2 FDPS 681/4885HRH4 3596/4885HRH1 4601/4885
US-20100028299-A1 Methods and compositions of treating a flaviviridae family viral infection EIF2AK2, NSUN3, NSUN2 FDPS 681/4885HRH4 3596/4885HRH1 4601/4885

“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.