SCHEMBL4075604

SCHEMBL4075604

OC(CNI)COc1cc(F)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 2/20 0.42
ALOX15 P16050 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
PKM P14618 1/20 0.40
HTT P42858 2/20 0.40
USP2 O75604 1/20 0.40
CASR P41180 2/20 0.39
SLC2A1 P11166 1/20 0.39
ADRA1D P25100 1/20 0.39
PPARG P37231 1/20 0.38
ATM Q13315 1/20 0.38
CYP1A2 P05177 1/20 0.37
GAA P10253 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL4080566 0.83 ALOX15 (0.41) MEN1KMT2AALDH1A1ALOX15PKM
SCHEMBL768596 0.81 KMT2A (0.52) MEN1KMT2AALDH1A1ALOX15NPSR1
SCHEMBL768595 0.81 KMT2A (0.52) MEN1KMT2AALDH1A1ALOX15NPSR1
SCHEMBL4072956 0.72 KDM4E (0.50) MEN1KMT2AALDH1A1NPSR1PKM
SCHEMBL4076693 0.72 ALOX15 (0.43) MEN1KMT2AALDH1A1ALOX15CASR
SCHEMBL4078537 0.71 KDM4E (0.39) KMT2AALDH1A1ALOX15HTTCASR
SCHEMBL4082452 0.71 MAPT (0.41) KMT2AALDH1A1ALOX15CYP1A2
SCHEMBL19607313 0.71 ADRB3 (0.38) KMT2AALDH1A1ALOX15
SCHEMBL4078535 0.70 ADRB1 (0.46) MEN1KMT2AALOX15
SCHEMBL23363940 0.69 ADRA1D (0.39) ALDH1A1NPSR1PKMADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066673-A2 TRICYCLIC COMPOUNDS AND ITS USE AS TYROSINE KINASE MODULATORS ChemBridge Research Laboratories, Inc. (US) 2009-06-10 EP disclosed
WO-2008021369-A2 TRICYCLIC COMPOUNDS AND ITS USE AS TYROSINE KINASE MODULATORS CHEMBRIDGE RESEARCH LABORATORIES, INC. (US) 2008-02-21 WO disclosed