SCHEMBL4628689

SCHEMBL4628689

N=C(NC(=O)c1ccccc1)Nc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.75
NPC1 O15118 6/20 0.75
SMN1; SMN2 Q16637 3/20 0.75
MEN1 O00255 5/20 0.59
KMT2A Q03164 5/20 0.59
LTA4H P09960 4/20 0.59
RXFP1 Q9HBX9 2/20 0.59
NR1H4 Q96RI1 1/20 0.57
LMNA P02545 1/20 0.56
ALDH1A1 P00352 2/20 0.55

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
SCHEMBL4629221 0.92 NPC1 (0.63) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4628976 0.92 NPC1 (0.63) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4628673 0.92 NPC1 (0.63) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4627472 0.89 RAB9A (0.79) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4628709 0.86 MEN1 (0.58) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4964241 0.86 NPC1 (1.00) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4628945 0.85 GPR55 (0.58) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4979973 0.84 MEN1 (0.69) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL4628742 0.84 LTA4H (0.63) RAB9ANPC1SMN1; SMN2MEN1KMT2A
SCHEMBL11492866 0.84 RAB9A (0.75) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1918272-A1 Pharmaceutically active compounds and methods of use Wyeth a Corporation of the State of Delaware (US) 2008-05-07 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 RAB9A 617/4885NPC1 140/4885SMN1; SMN2 53/4885

“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.