SCHEMBL2386458

SCHEMBL2386458

c1ccc2nc3cccnc3cc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.62
MAPT P10636 3/20 0.61
GLA P06280 2/20 0.61
HPGD P15428 2/20 0.61
ACHE P22303 1/20 0.61
NQO2 P16083 2/20 0.58
NPC1 O15118 3/20 0.54
POLB P06746 2/20 0.54
RAB9A P51151 2/20 0.54
CYP3A4 P08684 1/20 0.52
CASP1 P29466 2/20 0.50
HTT P42858 2/20 0.50
KDM4E B2RXH2 2/20 0.50
TP53 P04637 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HSP90AB1 P08238 1/20 0.50
TSHR P16473 1/20 0.50
ATM Q13315 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL31242880 1.00 ALDH1A1 (0.62) ALDH1A1MAPTGLAHPGDACHE
SCHEMBL29524245 1.00 ALDH1A1 (0.62) ALDH1A1MAPTGLAHPGDACHE
Ammonia Solution, Strong SCHEMBL27985513 0.98 ALDH1A1 (0.60) ALDH1A1MAPTGLAHPGDACHE
SCHEMBL13156498 0.96 NQO2 (0.60) ALDH1A1MAPTGLAHPGDACHE
Pyridine SCHEMBL28887650 0.90 ALDH1A1 (0.52) ALDH1A1MAPTGLAHPGDACHE
SCHEMBL19198262 0.87 NQO2 (0.60) ALDH1A1MAPTGLAHPGDACHE
SCHEMBL9394410 0.87 ALDH1A1 (0.62) ALDH1A1MAPTGLAHPGDACHE
Acridine SCHEMBL463236 0.86 ALDH1A1 (0.77) ALDH1A1MAPTGLAHPGDACHE
SCHEMBL20272948 0.86 ALDH1A1 (0.54) ALDH1A1MAPTGLAHPGDACHE
SCHEMBL29066655 0.84 ALDH1A1 (0.58) ALDH1A1MAPTGLAHPGDACHE

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 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114685427-A Quinoline bipyridyl compound and application thereof in organic electroluminescent element 常州强力昱镭光电材料有限公司 2022-07-01 CN claimed
CN-104292227-B A kind of aza-acridine aromatic rings derivant and preparation method and application 河南中医学院 2016-09-28 CN claimed
CN-104292227-A Aza-acridine aromatic ring derivative as well as preparation method and application thereof UNIV HENAN TCM 2015-01-21 CN claimed
EP-1140932-B1 1,8-BENZONAPHTHYRIDINE DERIVATIVES AVENTIS PHARMA SA (FR) 2004-03-17 EP claimed
EP-1140932-A1 1,8-BENZONAPHTHYRIDINE DERIVATIVES Aventis Pharma S.A. (FR) 2001-10-10 EP claimed
WO-2000037467-A1 1,8-BENZONAPHTHYRIDINE DERIVATIVES AVENTIS PHARMA S.A. (FR) 2000-06-29 WO claimed
EP-0641341-B1 METHOD FOR PREPARING BENZO [b]NAPHTHYRIDINES RHONE POULENC RORER SA (FR) 2000-03-01 EP claimed
EP-0606382-B1 1,8-BENZONAPHTHYRIDINE DERIVATIVES AND ANTIMICROBIAL COMPOSITIONS BELLON LABOR SA ROGER (FR) 1998-05-13 EP claimed
US-5624933-A Process for the preparation of a 6-fluoro-2-halo-quinoline RHONE-POULENC RORER S.A. (FR) 1997-04-29 US claimed
US-5484921-A Process for preparing benzo[b]naphthyridines LABORATOIRE ROGER BELLON (FR) 1996-01-16 US claimed
EP-0606382-A1 1,8-BENZONAPHTHYRIDINE DERIVATIVES AND ANTIMICROBIAL COMPOSITIONS LABORATOIRE ROGER BELLON (FR) 1994-07-20 EP claimed
EP-0431991-B1 1,8-Benzonaphthyridine derivatives, their preparation and compositions containing them BELLON LABOR SA ROGER (FR) 1994-01-12 EP claimed
EP-0379412-B1 1,8-Benzonaphthyridine derivatives, their preparation and compositions containing them BELLON LABOR SA ROGER (FR) 1993-12-01 EP claimed
WO-1993007144-A1 1,8-BENZONAPHTHYRIDINE DERIVATIVES AND ANTIMICROBIAL COMPOSITIONS LABORATOIRE ROGER BELLON (FR) 1993-04-15 WO claimed
WO-1993007145-A1 METHOD FOR PREPARING BENZO[b]NAPHTHYRIDINES LABORATOIRE ROGER BELLON (FR) 1993-04-15 WO claimed
EP-0536035-A1 1,8-Benzonaphthyridine derivatives and antimicrobial compositions LABORATOIRE ROGER BELLON (FR) 1993-04-07 EP claimed
EP-0431991-A1 1,8-Benzonaphthyridine derivatives, their preparation and compositions containing them Société anonyme dite: LABORATOIRE ROGER BELLON (FR) 1991-06-12 EP claimed
EP-0379412-A1 1,8-Benzonaphthyridine derivatives, their preparation and compositions containing them Société anonyme dite: LABORATOIRE ROGER BELLON (FR) 1990-07-25 EP claimed
US-4061638-A Organocalciumpyridine-type polymerization initiators PHILLIPS PETROLEUM COMPANY (US) 1977-12-06 US claimed
US-3997708-A ADDITION PHILLIPS PETROLEUM COMPANY (US) 1976-12-14 US claimed