SCHEMBL4654089

SCHEMBL4654089

NC(=O)C(=O)NNC(=O)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.59
NPC1 O15118 5/20 0.59
CTDSP1 Q9GZU7 2/20 0.59
SMN1; SMN2 Q16637 4/20 0.58
CYP2C9 P11712 2/20 0.58
GAA P10253 2/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
POLB P06746 3/20 0.55
KDM4E B2RXH2 2/20 0.55
MAOA P21397 1/20 0.55
PTGS2 P35354 1/20 0.53
ALDH1A1 P00352 2/20 0.52
HSD17B10 Q99714 2/20 0.50
HDAC3 O15379 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
IDO1 P14902 1/20 0.50
ALOX15 P16050 1/20 0.50
HDAC1 Q13547 1/20 0.50

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
SCHEMBL28875360 0.87 SMN1; SMN2 (0.71) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL2745954 0.85 SMN1; SMN2 (0.60) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL2897981 0.85 RAB9A (0.65) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL400890 0.84 RAB9A (0.77) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL20281086 0.83 RAB9A (0.63) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL12324391 0.82 RAB9A (0.82) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL27304504 0.81 RAB9A (0.61) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL9811778 0.81 ALDH1A1 (0.64) RAB9ANPC1CTDSP1GAAMEN1
SCHEMBL5468686 0.79 RAB9A (0.59) RAB9ANPC1CTDSP1SMN1; SMN2CYP2C9
SCHEMBL37273 0.79 ALDH1A1 (0.68) RAB9ANPC1CTDSP1SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644320-B1 INDANE DERIVATES AS MUSCARINIC RECEPTOR AGONISTS LILLY CO ELI (US) 2008-01-16 EP disclosed
US-7265246-B2 Indane derivates as muscarinic receptor agonists ELI LILLY AND COMPANY (US) 2007-09-04 US disclosed
US-20070060587-A1 Indane derivates as muscarinic receptor agonists ELI LILLY AND COMPANY (US) 2007-03-15 US disclosed
EP-1644320-A1 INDANE DERIVATES AS MUSCARINIC RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2006-04-12 EP disclosed
WO-2005009941-A1 INDANE DERIVATES AS MUSCARINIC RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2005-02-03 WO 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-20070060587-A1 Indane derivates as muscarinic receptor agonists CHRM1, CHRM3, CHRM2 RAB9A 2873/4885NPC1 1412/4885CTDSP1 3562/4885

“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.