SCHEMBL23965805

SCHEMBL23965805

c1cnc(CNc2nc3ccccc3s2)nc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.60
RAB9A P51151 9/20 0.60
SMN1; SMN2 Q16637 5/20 0.60
KMT2A Q03164 4/20 0.60
MEN1 O00255 2/20 0.57
IDO1 P14902 1/20 0.54
HPGD P15428 1/20 0.52
MAPK1 P28482 1/20 0.52
MAPT P10636 4/20 0.51
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL23965797 0.86 NPC1 (0.56) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL1913680 0.81 NPC1 (0.71) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL23965804 0.80 RAB9A (0.56) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL23965829 0.80 GAA (0.48) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL1913774 0.77 NPC1 (0.61) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL14394876 0.77 NPC1 (0.65) NPC1RAB9ASMN1; SMN2KMT2AIDO1
SCHEMBL19792507 0.76 NPC1 (0.72) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL28145919 0.76 NPC1 (0.63) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL27834923 0.76 NPC1 (0.68) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL27834922 0.76 CNR1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMEN1

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.