SCHEMBL32670686

SCHEMBL32670686

O=C(NC1CCN(CCO)CC1)c1ccc2nc[nH]c2c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.65
LMNA P02545 1/20 0.65
SMYD3 Q9H7B4 3/20 0.62
HDAC6 Q9UBN7 1/20 0.52
F2 P00734 1/20 0.49
ST14 Q9Y5Y6 1/20 0.49
HTT P42858 2/20 0.49
SLC6A5 Q9Y345 1/20 0.48
BRD4 O60885 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
DRD4 P21917 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
POLB P06746 2/20 0.46
EPHX1 P07099 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL1052812 0.86 NPC1 (0.74) NPC1LMNASMYD3HDAC6HTT
SCHEMBL10268218 0.84 NPC1 (0.71) NPC1LMNASMYD3HDAC6F2
SCHEMBL112036 0.83 NPC1 (0.69) NPC1LMNASMYD3HDAC6F2
SCHEMBL3984997 0.82 NPC1 (0.79) NPC1LMNASMYD3HDAC6HTT
SCHEMBL1052303 0.82 NPC1 (0.68) NPC1LMNASMYD3HDAC6HTT
SCHEMBL32670580 0.81 HTT (0.58) NPC1LMNASMYD3HDAC6HTT
SCHEMBL30265317 0.81 NPC1 (0.81) NPC1LMNASMYD3HDAC6HTT
SCHEMBL32670673 0.80 LMNA (0.69) NPC1LMNASMYD3HDAC6HTT
SCHEMBL19710135 0.79 NPC1 (0.78) NPC1LMNASMYD3HDAC6HTT
SCHEMBL21489973 0.79 NPC1 (0.78) NPC1LMNASMYD3HDAC6HTT

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-20260034107-A1 SUBSTITUTED FUSED IMIDAZOLE DERIVATIVES AND METHODS OF TREATING SICKLE CELL DISEASE AND RELATED COMPLICATIONS VTV THERAPEUTICS LLC (US) 2026-02-05 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-20260034107-A1 SUBSTITUTED FUSED IMIDAZOLE DERIVATIVES AND METHODS OF TREATING SICKLE CELL DISEASE AND RELATED COMPLICATIONS HBB, HBZ, HBG1 NPC1 868/4885LMNA 973/4885SMYD3 344/4885

“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.