SCHEMBL8304353

SCHEMBL8304353

CC1(C)C(=O)Nc2ccc(Cl)cc2C1=NN

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.46
CES1 P23141 1/20 0.46
PGR P06401 3/20 0.43
MAPT P10636 1/20 0.43
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
IDO1 P14902 2/20 0.40
TDO2 P48775 1/20 0.40
MAOB P27338 1/20 0.40
LRRK2 Q5S007 2/20 0.39
PPOX P50336 1/20 0.39
MGAT1 P26572 1/20 0.38
MGAT3 Q09327 1/20 0.38
MGAT2 Q10469 1/20 0.38
CHEK1 O14757 1/20 0.38

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
SCHEMBL8304351 1.00 TGM2 (0.46) TGM2CES1PGRMAPTCA1
SCHEMBL8881911 0.85 TGM2 (0.46) TGM2CES1PGRMAPTIDO1
SCHEMBL8880831 0.85 TGM2 (0.46) TGM2CES1PGRMAPTIDO1
SCHEMBL8880758 0.79 MAOB (0.41) TGM2CES1PGRMAPTIDO1
SCHEMBL8881059 0.79 TGM2 (0.41) TGM2CES1PGRMAPTIDO1
SCHEMBL8880752 0.79 MAOB (0.41) TGM2CES1PGRMAPTIDO1
SCHEMBL7426938 0.79 MAPT (0.55) TGM2CES1PGRMAPTIDO1
SCHEMBL8880980 0.77 MDM2 (0.40) TGM2CES1PGRMAPTCA1
SCHEMBL8296634 0.74 MAOB (0.47) TGM2CES1PGRMAPTMAOB
SCHEMBL8296633 0.74 MAOB (0.47) TGM2CES1PGRMAPTMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579968-B1 4-Iminoquinolines, processes for their preparation and their use HOECHST AG (DE) 1999-09-01 EP disclosed
US-5602146-A ANTIVIRAL AGENT HOECHST AKTIENGESELLSCHAFT (DE) 1997-02-11 US disclosed
EP-0579968-A1 4-Iminoquinolines, processes for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-26 EP disclosed