SCHEMBL8968363

SCHEMBL8968363

Cc1cccn2c(=N)c3c(Cl)cc(Cl)cc3nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.40
NPSR1 Q6W5P4 2/20 0.40
MAPT P10636 1/20 0.40
RECQL P46063 1/20 0.40
HTR6 P50406 1/20 0.39
PTPN1 P18031 2/20 0.38
TP53 P04637 1/20 0.37
ALDH1A1 P00352 5/20 0.37
GAA P10253 4/20 0.37
HPGD P15428 3/20 0.37
HSD17B10 Q99714 3/20 0.37
GLA P06280 2/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
ATM Q13315 1/20 0.37
KMT2A Q03164 2/20 0.36
CASP1 P29466 2/20 0.36
CASP7 P55210 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36

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
SCHEMBL8968872 0.87 PTPN1 (0.34) KDM4ENPSR1MAPTPTPN1ALDH1A1
SCHEMBL8968984 0.83 PDE2A (0.36) KDM4ENPSR1MAPTPTPN1ALDH1A1
SCHEMBL8968968 0.75 KDM4E (0.53) KDM4ENPSR1MAPTHTR6ALDH1A1
SCHEMBL8969355 0.75 HTR6 (0.41) KDM4EMAPTHTR6TP53ALDH1A1
SCHEMBL8969226 0.72 KDM4E (0.38) KDM4ENPSR1MAPTPTPN1ALDH1A1
SCHEMBL8969345 0.72 NR1H4 (0.39) KDM4EMAPTHTR6TP53ALDH1A1
SCHEMBL8968970 0.72 KDM4E (0.48) KDM4ENPSR1MAPTHTR6ALDH1A1
SCHEMBL8970270 0.70 HTR6 (0.41) KDM4ENPSR1MAPTHTR6TP53
SCHEMBL8969266 0.69 CYP11B1 (0.34) KDM4ENPSR1MAPTALDH1A1GAA
SCHEMBL8969761 0.68 HTT (0.42) KDM4ENPSR1MAPTTP53ALDH1A1

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