SCHEMBL22326455

SCHEMBL22326455

CCCNCCc1nc2ccccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.62
HTT P42858 1/20 0.61
DDAH1 O94760 1/20 0.60
POLB P06746 1/20 0.60
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
LMNA P02545 2/20 0.55
PKM P14618 1/20 0.54
KDM4E B2RXH2 1/20 0.54
CSNK2A2 P19784 1/20 0.53
CSNK2B P67870 1/20 0.53
CSNK2A1 P68400 1/20 0.53
CSNK2A3 Q8NEV1 1/20 0.53
PDE10A Q9Y233 1/20 0.52

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
SCHEMBL21486245 0.89 SMN1; SMN2 (0.63) SMN1; SMN2HTTDDAH1POLBNPC1
SCHEMBL11353975 0.84 POLB (0.65) SMN1; SMN2HTTDDAH1POLBNPC1
SCHEMBL612507 0.83 DDAH1 (0.72) SMN1; SMN2HTTDDAH1POLBNPC1
SCHEMBL29749508 0.83 DDAH1 (0.72) SMN1; SMN2HTTDDAH1POLBNPC1
SCHEMBL7272275 0.82 POLB (0.67) SMN1; SMN2HTTDDAH1POLBLMNA
SCHEMBL2851401 0.82 PKM (0.68) SMN1; SMN2HTTDDAH1POLBNPC1
Hydrochloric Acid SCHEMBL8323737 0.81 PKM (0.71) SMN1; SMN2HTTDDAH1POLBNPC1
SCHEMBL379648 0.80 POLB (0.79) SMN1; SMN2DDAH1POLBNPC1RAB9A
SCHEMBL20707630 0.80 RAB9A (0.67) SMN1; SMN2HTTPOLBNPC1RAB9A
SCHEMBL25248849 0.80 CHRM1 (0.74) SMN1; SMN2HTTPOLBNPC1RAB9A

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-10738041-B2 Ferroportin inhibitors VIFOR (INTERNATIONAL) AG (CH) 2020-08-11 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-10738041-B2 Ferroportin inhibitors SLC40A1, HAMP, TFRC SMN1; SMN2 3085/4885HTT 1074/4885DDAH1 1614/4885

“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.