SCHEMBL8969345

SCHEMBL8969345

Cc1ccc2nc3cc(Cl)cc(Cl)c3c(=N)n2c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 11/20 0.39
HTR6 P50406 2/20 0.39
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TP53 P04637 2/20 0.36
GAA P10253 2/20 0.36
POLB P06746 1/20 0.36
PKM P14618 2/20 0.34
PKLR P30613 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL8970270 0.87 HTR6 (0.41) NR1H4HTR6MAPTKDM4EALDH1A1
SCHEMBL8969480 0.83 HTR6 (0.39) NR1H4HTR6MAPTKDM4EALDH1A1
SCHEMBL8969355 0.81 HTR6 (0.41) HTR6MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL8968968 0.78 KDM4E (0.53) HTR6MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL8969226 0.75 KDM4E (0.38) MAPTKDM4EALDH1A1NPC1RAB9A
SCHEMBL8969177 0.73 KDM4E (0.50) HTR6MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL8969761 0.73 HTT (0.42) MAPTSMN1; SMN2KDM4EALDH1A1NPC1
SCHEMBL8969266 0.72 CYP11B1 (0.34) MAPTKDM4EALDH1A1NPC1RAB9A
SCHEMBL8968363 0.72 KDM4E (0.40) HTR6MAPTKDM4EALDH1A1NPC1
SCHEMBL8968970 0.72 KDM4E (0.48) HTR6MAPTSMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5486512-A LEARNING ENHANCEMENT WARNER-LAMBERT COMPANY (US) 1996-01-23 US disclosed