SCHEMBL7119213

SCHEMBL7119213

CC1CCc2[nH]c3ccccc3c(=O)c2C1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.68
HSD17B10 Q99714 2/20 0.68
TP53 P04637 1/20 0.68
SLC2A1 P11166 1/20 0.62
KDM4E B2RXH2 3/20 0.60
ALDH1A1 P00352 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
KMT2A Q03164 3/20 0.54
NR2E1 Q9Y466 1/20 0.54
MEN1 O00255 2/20 0.51
LMNA P02545 2/20 0.48
RB1 P06400 1/20 0.46
GLA P06280 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
ATM Q13315 1/20 0.46
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
SCHEMBL2515919 0.89 NR2E1 (0.67) HPGDHSD17B10TP53SLC2A1KMT2A
SCHEMBL26837000 0.80 NR2E1 (0.59) HPGDHSD17B10TP53KDM4EALDH1A1
SCHEMBL8579183 0.80 RB1 (0.63) HPGDHSD17B10TP53KDM4ENR2E1
SCHEMBL32667958 0.76 KDM4E (1.00) HPGDHSD17B10TP53SLC2A1KDM4E
SCHEMBL1383033 0.76 KDM4E (1.00) HPGDHSD17B10TP53SLC2A1KDM4E
SCHEMBL22592083 0.75 KMT2A (0.48) HPGDHSD17B10TP53SLC2A1KDM4E
SCHEMBL11076324 0.74 NR2E1 (0.54) HPGDHSD17B10KDM4EALDH1A1KMT2A
SCHEMBL2630572 0.73 KDM4E (0.66) HPGDHSD17B10TP53SLC2A1KDM4E
SCHEMBL29378703 0.73 KDM4E (0.66) HPGDHSD17B10TP53SLC2A1KDM4E
SCHEMBL30583743 0.73 KDM4E (0.66) HPGDHSD17B10TP53SLC2A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225078-A1 Derivatives of quinoline as alpha-2 antagonists ORION CORPORATION 2003-12-04 US disclosed
US-6593324-B2 P-aminoanilino- derivatives ORION CORPORATION (FI) 2003-07-15 US disclosed
EP-1263733-A2 DERIVATIVES OF QUINOLINE AS ALPHA-2 ANTAGONISTS ORION CORPORATION FARMOS (FI) 2002-12-11 EP disclosed
US-20010046991-A1 Derivatives of quinoline as alpha-2 antagonists OY JUVANTIA PHARMA LTD. (FI) 2001-11-29 US disclosed
WO-2001064645-A2 DERIVATIVES OF QUINOLINE AS ALPHA-2 ANTAGONISTS ORION CORPORATION (FI) 2001-09-07 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-20030225078-A1 Derivatives of quinoline as alpha-2 antagonists ADRB2, ADRA2A, ADRB1 HPGD 2199/4885HSD17B10 3073/4885TP53 2938/4885
US-20010046991-A1 Derivatives of quinoline as alpha-2 antagonists ADRB2, ADRA2A, ADRB1 HPGD 2199/4885HSD17B10 3073/4885TP53 2938/4885

“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.