SCHEMBL7500873

SCHEMBL7500873

Fc1ccc(-c2nc(Cl)c3c(n2)CCCC3)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
ADORA2A P29274 1/20 0.45
HTR2A P28223 2/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44
ACHE P22303 6/20 0.43
BCHE P06276 5/20 0.43
GRIN1 Q05586 5/20 0.43
GRIN2A Q12879 5/20 0.43
PTGS2 P35354 1/20 0.43
POLB P06746 2/20 0.42
NPC1 O15118 2/20 0.42
HPGD P15428 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SOS1 Q07889 1/20 0.41
LMNA P02545 3/20 0.40

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
SCHEMBL2269708 0.97 KDM4E (0.48) KDM4EADORA2AHTR2AHTR2CHTR2B
SCHEMBL6075340 0.87 TP53 (0.48) KDM4EACHEBCHEGRIN1GRIN2A
SCHEMBL6077222 0.84 ACHE (0.40) ACHEBCHEGRIN1GRIN2ASMN1; SMN2
SCHEMBL6076028 0.84 KDM4E (0.47) KDM4EACHEBCHEGRIN1GRIN2A
SCHEMBL2624086 0.83 LMNA (0.56) KDM4EACHEBCHEGRIN1GRIN2A
SCHEMBL5734234 0.83 TP53 (0.45) KDM4EACHEBCHEGRIN1GRIN2A
SCHEMBL15921329 0.81 ACHE (0.43) ACHEBCHEGRIN1GRIN2APTGS2
SCHEMBL2269571 0.81 ALDH1A1 (0.44) KDM4EACHEBCHEGRIN1GRIN2A
SCHEMBL6075299 0.80 NSD2 (0.46) KDM4EADORA2AHTR2AHTR2CHTR2B
SCHEMBL6075321 0.80 HRH2 (0.55) KDM4EACHEBCHEGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826673-B1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO (JP) 2002-11-20 EP disclosed
US-5972946-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0826673-A1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-03-04 EP disclosed