SCHEMBL4967968

SCHEMBL4967968

CC(C)(C)Oc1ccnc(C(=O)N2CCOCC2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 11/20 0.46
▸ NPC1 O15118 10/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ LRRK2 Q5S007 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.42
▸ HSP90AB1 P08238 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MAPK1 P28482 1/20 0.41

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
SCHEMBL3186273 0.80 SMN1; SMN2 (0.49) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL12233588 0.79 RAB9A (0.45) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL15223500 0.78 RAB9A (0.56) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL15971808 0.77 PRKDC (0.46) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL3439414 0.75 RAB9A (0.56) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL29417566 0.75 SMN1; SMN2 (0.52) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL11918962 0.75 SMN1; SMN2 (0.49) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL28296111 0.73 ALDH1A1 (0.52) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL12257113 0.72 RAB9A (0.50) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1
SCHEMBL28045432 0.71 SMN1; SMN2 (0.48) RAB9ANPC1SMN1; SMN2LRRK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1904494-A1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS ELI LILLY AND COMPANY (US) 2008-04-02 — — EP disclosed
WO-2006091671-A1 IMIDAZO (1, 2-A) PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS ELI LILLY AND COMPANY (US) 2006-08-31 — — WO disclosed
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