SCHEMBL13680449

SCHEMBL13680449

Cc1cccc(-c2ccc(N(C)C)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.56
CCR8 P51685 1/20 0.56
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CYP2A6 P11509 1/20 0.49
APP P05067 7/20 0.46
MAPT P10636 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ADK P55263 1/20 0.43
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 3/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
PKM P14618 1/20 0.42
HTT P42858 1/20 0.42
GFER P55789 1/20 0.42
TSHR P16473 2/20 0.42

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
SCHEMBL11287805 0.88 MEN1 (0.52) RAB9AAPPMAPTSMN1; SMN2ADK
SCHEMBL3422361 0.85 CCR1 (0.75) CCR1CCR8RAB9ACYP2A6MAPT
SCHEMBL2614970 0.79 CCR1 (0.65) CCR1CCR8NPC1RAB9AL3MBTL1
SCHEMBL18730183 0.79 ASIC3 (0.60) APPMAPTSMN1; SMN2ADKALDH1A1
SCHEMBL2189142 0.78 KMT2A (0.62) CCR1CCR8NPC1RAB9AL3MBTL1
SCHEMBL647992 0.77 MEN1 (0.68) CCR1CCR8NPC1RAB9ACYP2A6
SCHEMBL29963679 0.77 MEN1 (0.68) CCR1CCR8NPC1RAB9ACYP2A6
SCHEMBL9848050 0.76 MAPT (0.47) NPC1RAB9AAPPMAPTSMN1; SMN2
SCHEMBL16189110 0.76 CCR1 (0.60) CCR1CCR8RAB9ACYP2A6MAPT
SCHEMBL2615266 0.76 CCR1 (0.60) CCR1CCR8NPC1RAB9AL3MBTL1

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
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed