SCHEMBL23965799

SCHEMBL23965799

Nc1ccc2nc(N3CCCC(O)C3)sc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 12/20 0.57
RAB9A P51151 12/20 0.57
SMN1; SMN2 Q16637 9/20 0.57
MAPT P10636 6/20 0.57
GAA P10253 1/20 0.57
ALDH1A1 P00352 3/20 0.48
HTT P42858 1/20 0.48
APOBEC3A P31941 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
CRBN Q96SW2 1/20 0.45
MAPK1 P28482 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GFER P55789 1/20 0.44
TP53 P04637 5/20 0.43
NFKB1 P19838 2/20 0.43
NFKB2 Q00653 2/20 0.43
RELA Q04206 2/20 0.43
MITF O75030 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL18344133 0.90 NPC1 (0.45) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL18344170 0.90 NPC1 (0.45) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL1096066 0.85 RAB9A (0.69) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL1096844 0.85 RAB9A (0.69) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL1096068 0.85 RAB9A (0.69) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL19326470 0.82 NPC1 (0.76) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL18344077 0.82 NPC1 (0.47) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL23965745 0.80 SMN1; SMN2 (0.60) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL1094011 0.78 HRH3 (0.61) NPC1RAB9ASMN1; SMN2MAPTGAA
SCHEMBL1094008 0.78 HRH3 (0.61) NPC1RAB9ASMN1; SMN2MAPTGAA

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-11161830-B2 4-pyridone compound or salt thereof, and pharmaceutical composition and formulation including same FUJIFILM CORPORATION (JP) 2021-11-02 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-11161830-B2 4-pyridone compound or salt thereof, and pharmaceutical composition and formulation including same HAVCR2, HBS1L, PHKB NPC1 1739/4885RAB9A 2878/4885SMN1; SMN2 4557/4885

“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.