SCHEMBL21311151

SCHEMBL21311151

CCCCCC(C)n1ncc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 1/20 0.45
CNR1 P21554 3/20 0.42
CNR2 P34972 3/20 0.42
SLC6A2 P23975 1/20 0.38
KMO O15229 1/20 0.37
RECQL P46063 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TLR8 Q9NR97 3/20 0.36
CHRM2 P08172 1/20 0.35
CHRM1 P11229 1/20 0.35
CYP1A2 P05177 1/20 0.35
SLC9A1 P19634 1/20 0.35
TP53 P04637 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 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
SCHEMBL22810539 0.89 SLC6A2 (0.40) ASAH1SLC6A2KMORECQLCHRM2
SCHEMBL22810558 0.84 ASAH1 (0.44) ASAH1CNR1CNR2SLC6A2RECQL
SCHEMBL3862440 0.82 RECQL (0.42) ASAH1SLC6A2KMORECQLSMN1; SMN2
SCHEMBL24729035 0.79 SLC6A2 (0.43) ASAH1SLC6A2KMORECQLCYP1A2
SCHEMBL30376517 0.79 ASAH1 (0.42) ASAH1SLC6A2KMORECQLSMN1; SMN2
SCHEMBL20181741 0.79 ASAH1 (0.42) ASAH1SLC6A2KMORECQLSMN1; SMN2
SCHEMBL29311444 0.78 KDM4E (0.40) CNR1CNR2TLR8L3MBTL1KDM4E
SCHEMBL25014849 0.78 KMO (0.36) ASAH1CNR1CNR2SLC6A2KMO
SCHEMBL6176042 0.78 KMO (0.43) ASAH1SLC6A2KMORECQLSMN1; SMN2
SCHEMBL20665056 0.75 KMO (0.62) KMOKMT2APOLBMEN1

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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-08-29 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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS POLRMT, EIF2AK2, NSUN3 ASAH1 399/4885CNR1 4542/4885CNR2 4792/4885

“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.