SCHEMBL6609155

SCHEMBL6609155

CNc1c2c(nc3ccccc13)CCNC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.45
ACHE P22303 7/20 0.44
HTR2C P28335 1/20 0.44
POLB P06746 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
BCHE P06276 6/20 0.43
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
APP P05067 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
GABRB2 P47870 1/20 0.43
GABRA4 P48169 1/20 0.43
BACE1 P56817 1/20 0.43

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
SCHEMBL6607605 0.83 HTT (0.50) MAPTKMT2AACHEPOLBNPSR1
Hydrochloric Acid SCHEMBL6607087 0.82 HTT (0.49) MAPTKMT2AACHEPOLBNPSR1
SCHEMBL6609348 0.81 MAPT (0.61) MAPTACHEHTR2CPOLBBCHE
SCHEMBL6605996 0.81 BCHE (0.45) MAPTACHEHTR2CBCHE
SCHEMBL7976500 0.81 ALDH1A1 (0.54) MAPTKMT2AACHEHTR2CPOLB
SCHEMBL14672739 0.80 KDM4E (0.57) ACHEPOLBBCHEGABRPGABRD
Hydrochloric Acid SCHEMBL6611847 0.80 HTT (0.47) MAPTKMT2APOLBAPP
SCHEMBL12300220 0.80 PABPC1 (0.71) ACHEBCHEPABPC1EIF4H
Hydrochloric Acid SCHEMBL7976524 0.79 ALDH1A1 (0.56) MAPTKMT2AACHEHTR2CPOLB
SCHEMBL6607775 0.79 ACHE (0.52) ACHEBCHEAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0997462-A1 NOVEL NAPHTHYRIDINE DERIVATIVES OR SALTS THEREOF Nippon Kayaku Kabushiki Kaisha (JP) 2000-05-03 EP claimed
EP-0997462-B1 NOVEL NAPHTHYRIDINE DERIVATIVES OR SALTS THEREOF NIPPON KAYAKU KK (JP) 2004-12-22 EP disclosed
US-6294547-B1 Naphthyridine deratives or salts thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-09-25 US disclosed
EP-0997462-A1 NOVEL NAPHTHYRIDINE DERIVATIVES OR SALTS THEREOF Nippon Kayaku Kabushiki Kaisha (JP) 2000-05-03 EP disclosed