SCHEMBL27997675

SCHEMBL27997675

Cc1ccccc1Cc1c[c]cc(N2CCN(C)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 3/20 0.46
▸ AGXT P21549 1/20 0.41
▸ HRH4 Q9H3N8 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40
▸ HTR3A P46098 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NCF1 P14598 2/20 0.39
▸ ADRA2C P18825 1/20 0.38
▸ KHK P50053 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ FFAR1 O14842 1/20 0.36
▸ KMT2A Q03164 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
SCHEMBL27997452 0.87 HTR6 (0.46) HTR6AGXTHRH4HRH3HTR3A
SCHEMBL27997678 0.87 HTR6 (0.46) HTR6AGXTHTR3ANCF1ADRA2C
SCHEMBL27997453 0.85 AGXT (0.47) HTR6AGXTHRH4HRH3HTR3A
SCHEMBL27997451 0.80 HTR6 (0.49) HTR6AGXTHRH4HRH3KDM4E
SCHEMBL27997677 0.77 AGXT (0.43) HTR6AGXTHRH4HRH3HTR3A
SCHEMBL27997446 0.75 SMO (0.41) HTR6AGXTHRH4NCF1
SCHEMBL27943398 0.74 NCF1 (0.46) AGXTHRH3HTR3AKDM4ENCF1
SCHEMBL14059902 0.69 CYP1A2 (0.47) HTR6AGXTHRH4HTR3ALMNA
SCHEMBL14060813 0.67 MAP4K1 (0.43) HTR6AGXTHRH4HTR3AADRA2C
SCHEMBL27943408 0.67 DRD2 (0.45) HTR6AGXTHTR3AKDM4EADRA2C

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
CN-104271576-A Pyridopyrimidinone inhibitors of kinases ABBVIE INC 2015-01-07 — — CN claimed
CN-104271576-A Pyridopyrimidinone inhibitors of kinases ABBVIE INC 2015-01-07 — — CN disclosed
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