SCHEMBL4751133

SCHEMBL4751133

Cc1cc(Br)cc2c1C(=O)N(N)C2

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TAS1R2 Q8TE23 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3R1 P27986 1/20 0.34
PIK3CG P48736 1/20 0.34
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
BRD4 O60885 1/20 0.32
EGFR P00533 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL29209082 0.81 BRD4 (0.42) TAS1R3TAS1R1TAS1R2PIK3CDPIK3R1
SCHEMBL31543989 0.77 PIK3CG (0.43) PIK3CDPIK3R1PIK3CG
SCHEMBL8166957 0.77 TAS1R3 (0.33) TAS1R3TAS1R1TAS1R2PIK3CDPIK3R1
SCHEMBL29099608 0.77 PIK3CG (0.43) PIK3CDPIK3R1PIK3CG
SCHEMBL4327713 0.76 HTR2A (0.38) PIK3CDPIK3R1PIK3CGHTR2AHTR2C
SCHEMBL1001568 0.75 PIK3CD (0.42) TAS1R3TAS1R1TAS1R2PIK3CDPIK3R1
SCHEMBL4329783 0.74 PIK3CG (0.41) PIK3CDPIK3R1PIK3CG
SCHEMBL2022710 0.74 TP53 (0.36) TP53MAPT
SCHEMBL2025050 0.73 PARP1 (0.48)
SCHEMBL2022642 0.73 TP53 (0.49) TP53MAPT

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
WO-2008130853-A1 HYDRAZIDES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS - 681 ASTRAZENECA AB (SE) 2008-10-30 WO disclosed
WO-2008130853-A1 HYDRAZIDES AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS - 681 ASTRAZENECA AB (SE) 2008-10-30 WO disclosed