SCHEMBL7102988

SCHEMBL7102988

O=c1ccc2ccccc2n1-c1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 2/20 0.46
CA12 O43570 1/20 0.46
BRD4 O60885 1/20 0.46
BRPF1 P55201 1/20 0.46
CA9 Q16790 1/20 0.46
BRD9 Q9H8M2 1/20 0.46
ALDH1A1 P00352 2/20 0.45
GAA P10253 2/20 0.45
KDM4E B2RXH2 1/20 0.45
EP300 Q09472 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 2/20 0.41
PDE5A O76074 1/20 0.41
PDE4A P27815 1/20 0.41
PDE1A P54750 1/20 0.41
PDE1B Q01064 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
PDE3B Q13370 1/20 0.41

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
SCHEMBL28487644 0.80 SMN1; SMN2 (0.45) KAT2BALDH1A1GAAKDM4EEP300
SCHEMBL30506084 0.75 CA12 (0.44) KAT2BCA12BRD4BRPF1CA9
SCHEMBL30440787 0.74 ALDH1A1 (0.49) KAT2BCA12BRD4BRPF1CA9
SCHEMBL30043505 0.73 CA12 (0.43) KAT2BCA12BRD4BRPF1CA9
SCHEMBL16339578 0.73 CA12 (0.43) KAT2BCA12BRD4BRPF1CA9
SCHEMBL28379997 0.73 SMN1; SMN2 (0.55) KAT2BALDH1A1GAAKDM4EEP300
SCHEMBL29408795 0.72 POLB (0.41) ALDH1A1GAAKDM4ESMN1; SMN2POLB
SCHEMBL30724191 0.72 POLB (0.41) KAT2BALDH1A1GAAKDM4EEP300
SCHEMBL30724190 0.72 POLB (0.41) KAT2BALDH1A1GAAKDM4EEP300
SCHEMBL29387435 0.72 SMN1; SMN2 (0.43) ALDH1A1GAAKDM4ESMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2280954-B1 6-PYRIDIN-3-YL-3,4-DIHYDRO-1H-QUINOLIN-2-ONE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF THE HUMAN ALDOSTERONE SYNTHASE CYP11B2 UNIV SAARLAND (DE) 2013-03-27 EP disclosed
EP-0846117-B1 PROCESS FOR PREPARATION OF BIPHENYL DERIVATIVES WYETH CORP (US) 2003-05-14 EP disclosed
US-5977372-A Chloro or bromo[2-[2-(tert-butyl)-2H-tetrazol-5-yl]phenyl]zinc intermediates AMERICAN HOME PRODUCTS CORPORATION (US) 1999-11-02 US disclosed
EP-0846117-A1 PROCESS FOR PREPARATION OF BIPHENYL DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-10 EP disclosed
US-5760220-A REACTING PROTECTED TETRAZOLYLPHENYL ZINC HALIDE WITH HALOPHENYLMETHYL PYRIDO/2,3-D/PYRIMIDONE IN PRESENCE OF PALLADIUM OR NICKEL CATALYST AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-02 US disclosed
WO-1996040684-A1 PROCESS FOR PREPARATION OF BIPHENYL DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1996-12-19 WO disclosed