SCHEMBL7359596

SCHEMBL7359596

C1=CN(c2ccccc2)Cc2[nH]c3c(c21)CCCC3

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PARP1 P09874 2/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 1/20 0.33
EGFR P00533 1/20 0.32
GFER P55789 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
TSHR P16473 1/20 0.31
MAPK10 P53779 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL7350946 0.82 CUL4A (0.39) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL7354835 0.82 CUL4A (0.36) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL7349449 0.80 GABRA1 (0.37) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL7359591 0.64 MEN1 (0.39) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL21899458 0.63 SMN1; SMN2 (0.38) PARP1KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14652652 0.62 SMN1; SMN2 (0.36) PARP1KDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL9720424 0.61 MGLL (0.41) MEN1KMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL11593915 0.60 SMN1; SMN2 (0.62) KMT2APARP1KDM4EALDH1A1SMN1; SMN2
SCHEMBL1553150 0.58 NPC1 (0.44) MEN1KMT2APARP1SMN1; SMN2HPGD
SCHEMBL30284584 0.58 NPC1 (0.44) MEN1KMT2APARP1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5367077-A Certain cycloalkyl and azacycloalkyl pyrrolopyridines; a new class of gaba rain receptor ligands NEUROGEN CORPORATION (US) 1994-11-22 US claimed
WO-1994025461-A1 CERTAIN CYCLOALKYL AND AZACYCLOALKYL PYRROLOPYRIDINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1994-11-10 WO claimed
US-5367077-A Certain cycloalkyl and azacycloalkyl pyrrolopyridines; a new class of gaba rain receptor ligands NEUROGEN CORPORATION (US) 1994-11-22 US disclosed
WO-1994025461-A1 CERTAIN CYCLOALKYL AND AZACYCLOALKYL PYRROLOPYRIDINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 1994-11-10 WO disclosed