SCHEMBL8355428

SCHEMBL8355428

CC1c2ccccc2CCc2cccnc21

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.39
RET P07949 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
OPRL1 P41146 3/20 0.38
KCNH2 Q12809 3/20 0.38
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
ADRA1A P35348 1/20 0.37
PDPK1 O15530 1/20 0.37
ACP3 P15309 1/20 0.37
CYP2D6 P10635 1/20 0.37
P2RX7 Q99572 1/20 0.36

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
SCHEMBL22193900 1.00 HTR2A (0.39) HTR2ARETHTR2CHTR2BOPRL1
SCHEMBL13611706 0.81 FNTA (0.58) FNTAFNTB
SCHEMBL4969358 0.80 FNTA (0.41) HTR2ARETOPRL1KCNH2FNTA
SCHEMBL12050758 0.79 P2RX7 (0.41) HTR2ARETOPRL1KCNH2FNTA
SCHEMBL22193783 0.79 RET (0.39) HTR2ARETOPRL1KCNH2FNTA
SCHEMBL6992704 0.78 PDPK1 (0.45) HTR2ARETOPRL1KCNH2FNTA
SCHEMBL16559194 0.78 FNTA (0.38) HTR2ARETOPRL1KCNH2FNTA
SCHEMBL8746509 0.78 HTR2A (0.52) HTR2ARETHTR2CHTR2BKCNH2
SCHEMBL24631673 0.77 HTR2A (0.46) HTR2ARETHTR2COPRL1KCNH2
SCHEMBL6992701 0.75 HTR2A (0.66) HTR2ARETHTR2CCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160228438-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA, INC. 2016-08-11 US disclosed
US-9328119-B2 AZA-pyridone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2016-05-03 US disclosed
US-20150072982-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF Janssen Pharmaceuticals, Inc. 2015-03-12 US disclosed
US-7598242-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2009-10-06 US disclosed
US-7598242-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2009-10-06 US disclosed
WO-2003053915-A2 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION (US) 2003-07-03 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-20160228438-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK HTR2A 2424/4885RET 2470/4885HTR2C 2595/4885
US-20150072982-A1 AZA-PYRIDONE COMPOUNDS AND USES THEREOF PNPO, ITPA, PDXK HTR2A 2424/4885RET 2470/4885HTR2C 2595/4885

“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.