SCHEMBL379238

SCHEMBL379238

c1cc2c(cc1Nc1ccc3c(c1)CCC3)CCC2

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.63
ADRA2A P08913 2/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
NPC1 O15118 9/20 0.52
RAB9A P51151 9/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 5/20 0.50
NFKB1 P19838 3/20 0.50
NFKB2 Q00653 3/20 0.50
RELA Q04206 3/20 0.50
POLB P06746 2/20 0.50
TP53 P04637 2/20 0.50
GAA P10253 1/20 0.50
HTT P42858 1/20 0.50
EGFR P00533 1/20 0.49
CYP26A1 O43174 1/20 0.48
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL25912039 0.95 RAPGEF4 (0.58) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL18583900 0.90 RAPGEF4 (0.52) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL12377130 0.89 NPC1 (0.62) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL1673420 0.88 RAPGEF4 (0.67) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL15152202 0.88 RAPGEF4 (0.53) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL8810023 0.86 CYP26A1 (0.53) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL8386481 0.85 NPC1 (0.57) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL3476199 0.83 EGFR (0.52) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL8634550 0.83 RAPGEF4 (0.62) RAPGEF4ADRA2AADRA2BADRA2CNPC1
SCHEMBL14981731 0.82 POLB (0.64) RAPGEF4ADRA2AADRA2BADRA2CNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015042337-A1 LUBRICANT COMPOSITIONS FOR DIRECT INJECTION ENGINES THE LUBRIZOL CORPORATION (US) 2015-03-26 WO disclosed
EP-1801105-B1 Dibenzo[b]perhydroheterocyclic amines and lubricating oil compositions CHEVRON ORONITE CO (US) 2012-01-25 EP disclosed
US-7847125-B2 Acridan derivatives as antioxidants CHEMTURA CORPORATION (US) 2010-12-07 US disclosed
US-7847125-B2 Acridan derivatives as antioxidants CHEMTURA CORPORATION (US) 2010-12-07 US disclosed
US-7838703-B2 Diaromatic amine derivatives as antioxidants CHEMTURA CORPORATION (US) 2010-11-23 US disclosed
US-7838703-B2 Diaromatic amine derivatives as antioxidants CHEMTURA CORPORATION (US) 2010-11-23 US disclosed
US-20090131293-A1 DIAROMATIC AMINE DERIVATIVES AS ANTIOXIDANTS LANXESS SOLUTIONS US INC. 2009-05-21 US disclosed
US-20090131293-A1 DIAROMATIC AMINE DERIVATIVES AS ANTIOXIDANTS LANXESS SOLUTIONS US INC. 2009-05-21 US disclosed
US-20090131290-A1 ACRIDAN DERIVATIVES AS ANTIOXIDANTS LANXESS SOLUTIONS US INC. 2009-05-21 US disclosed
US-20090131290-A1 ACRIDAN DERIVATIVES AS ANTIOXIDANTS LANXESS SOLUTIONS US INC. 2009-05-21 US 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-20090131293-A1 DIAROMATIC AMINE DERIVATIVES AS ANTIOXIDANTS CAT, C5, C9 RAPGEF4 3912/4885ADRA2A 2060/4885ADRA2B 2205/4885
US-20090131290-A1 ACRIDAN DERIVATIVES AS ANTIOXIDANTS GPX1, C9, ACR RAPGEF4 3950/4885ADRA2A 1772/4885ADRA2B 1983/4885

“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.