SCHEMBL4849572

SCHEMBL4849572

CCc1ccc(C(=O)c2cc(Cl)ccc2N)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.53
GAA P10253 4/20 0.50
EGFR P00533 1/20 0.49
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
NOS2 P35228 2/20 0.48
ALDH1A1 P00352 3/20 0.48
LMNA P02545 2/20 0.48
NPC1 O15118 2/20 0.48
POLB P06746 1/20 0.48
AGTR1 P30556 1/20 0.48
MAPK1 P28482 2/20 0.47
NLRP1 Q9C000 1/20 0.47
MAPT P10636 5/20 0.47
TDP1 Q9NUW8 1/20 0.47
HTT P42858 1/20 0.47
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL6351799 0.85 RECQL (0.64) RECQLGAANOS2ALDH1A1NPC1
SCHEMBL9063310 0.84 GAA (0.59) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL48194 0.83 CNR2 (0.57) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL10396907 0.83 MAPT (0.67) RECQLGAANOS2ALDH1A1LMNA
SCHEMBL11311902 0.82 CNR2 (0.53) GAAEGFRCNR1CNR2ALDH1A1
SCHEMBL12653273 0.82 RECQL (0.60) RECQLGAANOS2ALDH1A1NPC1
SCHEMBL4844927 0.82 MAPT (0.70) RECQLGAAALDH1A1LMNANPC1
SCHEMBL6332774 0.81 RECQL (0.58) RECQLALDH1A1LMNANPC1POLB
SCHEMBL10370243 0.81 MAPT (0.65) GAAALDH1A1NPC1POLBMAPK1
SCHEMBL9712508 0.81 GAA (0.49) GAAEGFRCNR1CNR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7939545-B2 additionally comprising at least one other antiviral agent BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-10 US disclosed
US-7939545-B2 additionally comprising at least one other antiviral agent BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-10 US disclosed
EP-2019825-B9 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INT (DE) 2011-01-26 EP disclosed
EP-2019825-B1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INT (DE) 2010-09-01 EP disclosed
US-20080221159-A1 Inhibitors of human immunodeficiency virus replication GILEAD SCIENCES, INC. 2008-09-11 US disclosed
US-20080221159-A1 Inhibitors of human immunodeficiency virus replication GILEAD SCIENCES, INC. 2008-09-11 US disclosed
US-7326788-B2 Selective, potent small molecule protein tyrosine kinase inhibitors; such as 6-chloro-3-(3-methyl-isoxazol-5-yl)-4-(pyridin-4-yl)-1H-quinolin-2-one JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-05 US disclosed
US-7326788-B2 Selective, potent small molecule protein tyrosine kinase inhibitors; such as 6-chloro-3-(3-methyl-isoxazol-5-yl)-4-(pyridin-4-yl)-1H-quinolin-2-one JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-05 US disclosed
US-7326788-B2 Selective, potent small molecule protein tyrosine kinase inhibitors; such as 6-chloro-3-(3-methyl-isoxazol-5-yl)-4-(pyridin-4-yl)-1H-quinolin-2-one JANSSEN PHARMACEUTICA N.V. (BE) 2008-02-05 US disclosed
WO-2007131350-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-11-22 WO disclosed
EP-1660087-A2 QUINOLINONE DERIVATIVES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-31 EP disclosed
US-20050049274-A1 Quinolinone derivatives as inhibitors of c-fms kinase JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-03 US disclosed
WO-2005009967-A2 QUINOLINONE DERIVATIVES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2005-02-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080221159-A1 Inhibitors of human immunodeficiency virus replication RTF2, RTF1, POLR1E RECQL 30/4885GAA 1927/4885EGFR 2731/4885
US-20050049274-A1 Quinolinone derivatives as inhibitors of c-fms kinase FLT3, ABL1, FES RECQL 838/4885GAA 4452/4885EGFR 271/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.