SCHEMBL4629430

SCHEMBL4629430

Cc1ccc(C(=O)NC(=N)NCCOc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.64
POLB P06746 4/20 0.60
RAB9A P51151 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
HPGD P15428 2/20 0.59
SCN5A Q14524 2/20 0.58
SCN2A Q99250 2/20 0.58
CASP3 P42574 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
MTNR1A P48039 1/20 0.54
MTNR1B P49286 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
LMNA P02545 2/20 0.52
ALDH1A1 P00352 1/20 0.52
TP53 P04637 1/20 0.52
MAPK1 P28482 1/20 0.52
HSD17B10 Q99714 1/20 0.52
RECQL P46063 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
SCHEMBL4629274 0.96 NPC1 (0.59) NPC1POLBRAB9ASMN1; SMN2HPGD
SCHEMBL4627556 0.89 NPC1 (0.61) NPC1POLBRAB9ASMN1; SMN2HPGD
SCHEMBL4629192 0.87 NPC1 (0.66) NPC1POLBRAB9ASMN1; SMN2HPGD
SCHEMBL4629479 0.85 NPC1 (0.56) NPC1POLBRAB9ASMN1; SMN2HPGD
SCHEMBL11424416 0.79 NPC1 (0.93) NPC1POLBRAB9ASMN1; SMN2HPGD
SCHEMBL4628964 0.78 SCN5A (0.65) NPC1POLBRAB9ASMN1; SMN2HPGD
SCHEMBL4629252 0.77 NPC1 (0.69) NPC1RAB9ASMN1; SMN2HPGDSCN5A
SCHEMBL4629427 0.77 SCN5A (0.70) NPC1POLBRAB9ASMN1; SMN2HPGD
SCHEMBL4628362 0.77 POLB (0.70) NPC1POLBRAB9ASMN1; SMN2SCN5A
SCHEMBL10495065 0.77 NPC1 (0.88) NPC1POLBRAB9ASMN1; SMN2HPGD

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1032556-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE WYETH CORP (US) 2007-12-19 EP claimed
US-7041702-B1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-05-09 US claimed
EP-1918272-A1 Pharmaceutically active compounds and methods of use Wyeth a Corporation of the State of Delaware (US) 2008-05-07 EP disclosed
EP-1032556-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE WYETH CORP (US) 2007-12-19 EP disclosed
US-20060270741-A1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-11-30 US disclosed
US-7041702-B1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-05-09 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-20060270741-A1 Pharmaceutically active compounds and methods of use GBA1, CTSA, GAA NPC1 140/4885POLB 2690/4885RAB9A 617/4885

“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.