SCHEMBL4079547

SCHEMBL4079547

Cc1ccc(Cl)c(C)c1OC(N)C(C)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 3/20 0.37
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SCN4A P35499 5/20 0.32
LMNA P02545 2/20 0.32
SCN1A P35498 2/20 0.32
SCN9A Q15858 2/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
NFKB1 P19838 2/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
KCNK3 O14649 1/20 0.32
CACNA1F O60840 1/20 0.32
KCNK2 O95069 1/20 0.32
GBA1 P04062 1/20 0.32
MAOA P21397 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL4079480 0.81 KMT2A (0.33) KMT2ASMN1; SMN2HTR2AHTR2B
SCHEMBL4073841 0.73 SMN1; SMN2 (0.49) KMT2ASMN1; SMN2LMNACYP1A2CYP3A4
SCHEMBL4081455 0.72 SCN5A (0.36) SCN5AKMT2ASCN4ALMNASCN1A
SCHEMBL4073220 0.72 MET (0.32)
SCHEMBL4072440 0.69 MAPT (0.35) LMNASLC6A4
SCHEMBL4073326 0.69 HTR1A (0.38) LMNACYP1A2CYP3A4CYP2D6NFKB1
SCHEMBL767680 0.68 TSHR (0.60) SCN5AKMT2ASMN1; SMN2SCN4ALMNA
SCHEMBL767679 0.68 TSHR (0.60) SCN5AKMT2ASMN1; SMN2SCN4ALMNA
SCHEMBL7913213 0.67 ALDH1A1 (0.44) KMT2ASMN1; SMN2LMNACYP1A2CYP3A4
SCHEMBL4072447 0.67 MRGPRX4 (0.35) SCN5A

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