SCHEMBL9754273

SCHEMBL9754273

Cc1c(C)n(Cc2ccccc2)c2c(Cl)nncc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
NR2F2 P24468 1/20 0.47
KDM4E B2RXH2 4/20 0.45
TSHR P16473 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TNF P01375 1/20 0.40
MAPT P10636 1/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL8314414 0.86 MAPT (0.49) FABP4MEN1KMT2ANR2F2KDM4E
SCHEMBL9738200 0.84 FABP4 (0.48) FABP4MEN1KMT2ANR2F2KDM4E
SCHEMBL9738020 0.83 FABP4 (0.44) FABP4MEN1KMT2ANR2F2KDM4E
SCHEMBL9740226 0.82 FABP4 (0.46) FABP4MEN1KMT2ANR2F2KDM4E
SCHEMBL9738021 0.81 FABP4 (0.40) FABP4MEN1KMT2ANR2F2KDM4E
SCHEMBL9739288 0.80 TSHR (0.40) MEN1KMT2AKDM4ETSHRNPSR1
SCHEMBL9738267 0.80 FABP4 (0.47) FABP4MEN1KMT2ANR2F2KDM4E
SCHEMBL9738063 0.80 CYP1A2 (0.46) FABP4MEN1KMT2ANR2F2KDM4E
SCHEMBL7476839 0.79 NPSR1 (0.40) KDM4ETSHRNPSR1LMNAALDH1A1
SCHEMBL1736585 0.78 FABP4 (0.53) FABP4MEN1KMT2ANR2F2KDM4E

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
WO-1991017164-A1 NOVEL PYRIDAZINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1991-11-14 WO disclosed