SCHEMBL8378491

SCHEMBL8378491

CCNc1cc[c]c([C]=O)c1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
RECQL P46063 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
AR P10275 2/20 0.31
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 1/20 0.30

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
SCHEMBL8945843 0.73 MAPT (0.33) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL6491041 0.72 ALDH1A1 (0.38) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL9739643 0.68 MAPT (0.37) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL5538032 0.67 MAPT (0.38) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL7672004 0.66 MAPT (0.38) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL20710 0.65
SCHEMBL5542218 0.65 MAPT (0.48) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL3363357 0.62 MAPT (0.50) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL8725842 0.61 MAPT (0.47) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL526383 0.61 MAPT (0.58) MAPTKDM4EALDH1A1POLBHPGD

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
US-5929114-A ADMINISTERING ANTIVIRAL COMPOUND WHICH EXTRUDES ZINC FROM NUCLEOCAPSID PROTEIN OF HUMAN IMMUNODEFICIENCY VIRUS WARNER-LAMBERT COMPANY (US) 1999-07-27 US claimed
US-5929114-A ADMINISTERING ANTIVIRAL COMPOUND WHICH EXTRUDES ZINC FROM NUCLEOCAPSID PROTEIN OF HUMAN IMMUNODEFICIENCY VIRUS WARNER-LAMBERT COMPANY (US) 1999-07-27 US disclosed
US-5734081-A Arylthio compounds WARNER-LAMBERT COMPANY (US) 1998-03-31 US disclosed