SCHEMBL8160902

SCHEMBL8160902

CCc1c(Cl)nc2cc(Br)ccc2c1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
MPO P05164 1/20 0.38
HTT P42858 3/20 0.37
LMNA P02545 2/20 0.37
NOD2 Q9HC29 1/20 0.37
ACHE P22303 1/20 0.36
PTGES O14684 6/20 0.36
MEN1 O00255 1/20 0.34
PRNP P04156 1/20 0.34
TP53 P04637 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PDE10A Q9Y233 1/20 0.34
PDE2A O00408 1/20 0.34
HRH4 Q9H3N8 1/20 0.33
ESR1 P03372 1/20 0.33

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
SCHEMBL8161548 0.79 RXFP1 (0.43) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL24373387 0.78 MPO (0.46) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL11985932 0.71 RXFP1 (0.51) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL5402128 0.71 MPO (0.43) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL18562326 0.71 RXFP1 (0.44) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL11985926 0.71 MPO (0.49) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL26612831 0.70 CSNK2A1 (0.42) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL31571092 0.69 KMT2A (0.50) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL25082426 0.69 MPO (0.51) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL379382 0.69 KMT2A (0.50) RXFP1CYP1A2CYP2D6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8778966-B2 Quinolinone derivatives as PARP and tank inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-07-15 US disclosed
US-8778966-B2 Quinolinone derivatives as PARP and tank inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-07-15 US disclosed
US-20130018017-A1 QUINOLINONE DERIVATIVES AS PARP AND TANK INHIBITORS VIALARD JORGE EDUARDO (BE) 2013-01-17 US disclosed
US-20130018017-A1 QUINOLINONE DERIVATIVES AS PARP AND TANK INHIBITORS VIALARD JORGE EDUARDO (BE) 2013-01-17 US disclosed
US-8299256-B2 Quinolinone derivatives as PARP and TANK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2012-10-30 US disclosed
US-8299256-B2 Quinolinone derivatives as PARP and TANK inhibitors JANSSEN PHARMACEUTICA NV (BE) 2012-10-30 US disclosed
US-20100168065-A1 QUINOLINONE DERIVATIVES AS PARP AND TANK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-07-01 US disclosed
US-20100168065-A1 QUINOLINONE DERIVATIVES AS PARP AND TANK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-07-01 US disclosed
WO-2008107478-A1 QUINOLINONE DERIVATIVES AS PARP AND TANK INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2008-09-12 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-20100168065-A1 QUINOLINONE DERIVATIVES AS PARP AND TANK INHIBITORS PARP1, PARP11, PARP3 RXFP1 1732/4885CYP1A2 2728/4885CYP2D6 2966/4885
US-20130018017-A1 QUINOLINONE DERIVATIVES AS PARP AND TANK INHIBITORS PARP1, PARP11, PARP3 RXFP1 1732/4885CYP1A2 2728/4885CYP2D6 2966/4885

“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.