SCHEMBL4895704

SCHEMBL4895704

Cc1cnc(-c2cccc(Nc3ccc(N4CCCCC4=O)cn3)n2)s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.36
AKR1C3 P42330 1/20 0.36
TYK2 P29597 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HPGDS O60760 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PIM1 P11309 2/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
CDK2 P24941 2/20 0.34
GAA P10253 1/20 0.34
HTR6 P50406 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PKM P14618 1/20 0.34
CCNA2 P20248 1/20 0.34
TNIK Q9UKE5 1/20 0.34
CYP3A4 P08684 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
Hydrochloric Acid SCHEMBL4896665 0.96 NPC1 (0.36) AKR1C3TYK2NPC1RAB9ASMN1; SMN2
SCHEMBL4903017 0.88 F10 (0.40) F10AKR1C3TYK2HPGDSHTR6
SCHEMBL4899219 0.88 F10 (0.35) F10AKR1C3TYK2HPGDSPIM1
SCHEMBL5262033 0.88 F10 (0.35) F10AKR1C3TYK2SMN1; SMN2HPGDS
Hydrochloric Acid SCHEMBL4896752 0.87 F10 (0.35) F10AKR1C3TYK2SMN1; SMN2HPGDS
SCHEMBL4900748 0.85 F10 (0.37) F10AKR1C3TYK2HPGDSGAA
SCHEMBL4891094 0.85 AKR1C3 (0.35) AKR1C3TYK2NPC1RAB9ASMN1; SMN2
SCHEMBL4902865 0.85 AKR1C3 (0.35) AKR1C3TYK2NPC1RAB9ASMN1; SMN2
SCHEMBL4899105 0.84 CCNA2 (0.46) TYK2CDK2CCNA2
Hydrochloric Acid SCHEMBL5312344 0.84 F10 (0.36) F10AKR1C3TYK2HPGDSGAA

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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators ICAGEN, INC. (US) 2008-05-08 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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators KCNJ2, KCNH2, KCNQ1 F10 1686/4885AKR1C3 1318/4885TYK2 2831/4885

“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.