SCHEMBL28018409

SCHEMBL28018409

OCC1CC[C@@H](N(Cc2ccccc2)Cc2ccccc2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 1/20 0.40
DPP8 Q6V1X1 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
SLC18A3 Q16572 2/20 0.38
GRIN2B Q13224 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.36
G6PC1 P35575 1/20 0.36
GBA1 P04062 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
ATM Q13315 1/20 0.35

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
SCHEMBL28018410 1.00 YTHDC1 (0.43) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL26038459 1.00 YTHDC1 (0.43) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL26038458 1.00 YTHDC1 (0.43) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL1543202 0.92 SLC6A2 (0.42) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL1543203 0.92 SLC6A2 (0.42) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL1543200 0.92 SLC6A2 (0.42) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL384299 0.90 SLC6A2 (0.49) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL481896 0.90 SLC6A2 (0.49) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL384300 0.90 SLC6A2 (0.49) YTHDC1SLC6A2SLC6A4SLC6A3DPP8
SCHEMBL15689071 0.88 SLC6A2 (0.43) YTHDC1SLC6A2SLC6A4SLC6A3DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104592231-A Novel Tricyclic Compounds ABBVIE INC 2015-05-06 CN disclosed