SCHEMBL8970476

SCHEMBL8970476

CC1CCn2c1nc1ccccc1c2=N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.47
BCHE P06276 1/20 0.47
CCR3 P51677 5/20 0.40
KDM4E B2RXH2 2/20 0.37
ATM Q13315 2/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 2/20 0.36
TP53 P04637 2/20 0.36
MEN1 O00255 2/20 0.36
TSHR P16473 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PKM P14618 1/20 0.35
HTR3E A5X5Y0 1/20 0.35
HTR3B O95264 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
SCHEMBL8968931 0.82 ACHE (0.47) ACHEBCHECCR3KDM4EATM
SCHEMBL8969391 0.82 ACHE (0.47) ACHEBCHECCR3KDM4EATM
SCHEMBL7685732 0.78 USP2 (0.44) ACHEBCHEMEN1TSHRKMT2A
SCHEMBL28915706 0.78 USP2 (0.44) ACHEBCHEMEN1TSHRKMT2A
SCHEMBL28583632 0.71 KDM4E (0.42) ACHEBCHEKDM4EATMHSD17B10
SCHEMBL8969328 0.70 CCR3 (0.38) ACHEBCHECCR3KDM4EMAPK1
SCHEMBL30842142 0.69 TAAR1 (0.44) TSHRUSP2MAPTHTT
SCHEMBL3385589 0.67 ACHE (0.67) ACHEBCHEKDM4EHSD17B10L3MBTL1
SCHEMBL8970098 0.67 CCR3 (0.37) ACHEBCHECCR3KDM4EATM
SCHEMBL9541773 0.66 MEN1 (0.66) ACHEBCHEKDM4EHSD17B10L3MBTL1

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-5486512-A LEARNING ENHANCEMENT WARNER-LAMBERT COMPANY (US) 1996-01-23 US disclosed
WO-1993003034-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-02-18 WO disclosed