SCHEMBL2452998

SCHEMBL2452998

OCCNc1ccc2ccccc2n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.62
ALDH1A1 P00352 3/20 0.62
GAA P10253 3/20 0.62
POLB P06746 2/20 0.62
MAPK1 P28482 2/20 0.56
NCF1 P14598 1/20 0.55
RAB9A P51151 8/20 0.53
NPC1 O15118 7/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
HPGD P15428 2/20 0.53
TP53 P04637 1/20 0.53
HTT P42858 1/20 0.53
HSD17B10 Q99714 1/20 0.53
GLA P06280 2/20 0.51
MITF O75030 1/20 0.51
LMNA P02545 1/20 0.51
TTR P02766 1/20 0.51
RAD52 P43351 1/20 0.51
HDAC6 Q9UBN7 1/20 0.49
KMT2A Q03164 1/20 0.46

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
SCHEMBL4848300 0.89 POLB (0.54) KDM4EALDH1A1GAAPOLBMAPK1
SCHEMBL4848123 0.88 NCF1 (0.50) KDM4EALDH1A1GAAPOLBNCF1
SCHEMBL11762958 0.86 PDE5A (0.49) KDM4EALDH1A1GAAPOLBNCF1
SCHEMBL5943486 0.85 NCF1 (0.59) KDM4EALDH1A1GAAPOLBNCF1
SCHEMBL11754025 0.84 BCHE (0.47) KDM4EALDH1A1GAAPOLBMAPK1
SCHEMBL9850350 0.83 NCF1 (0.57) KDM4EALDH1A1GAAPOLBNCF1
SCHEMBL13365646 0.82 KDM4E (0.61) KDM4EALDH1A1GAAPOLBMAPK1
SCHEMBL7511217 0.81 NCF1 (0.60) KDM4ENCF1RAB9ANPC1SMN1; SMN2
SCHEMBL5943525 0.81 NCF1 (0.55) KDM4EALDH1A1GAANCF1RAB9A
Hydrochloric Acid SCHEMBL15286478 0.80 NCF1 (0.53) KDM4EALDH1A1GAANCF1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8969577-B2 Curable composition comprising a thermolatent base BASF SE (DE) 2015-03-03 US disclosed
US-8969577-B2 Curable composition comprising a thermolatent base BASF SE (DE) 2015-03-03 US disclosed
US-8969577-B2 Curable composition comprising a thermolatent base BASF SE (DE) 2015-03-03 US disclosed
EP-2367794-B1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2013-01-09 EP disclosed
EP-2367794-B1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2013-01-09 EP disclosed
US-20110245375-A1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2011-10-06 US disclosed
US-20110245375-A1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2011-10-06 US disclosed
US-20110245375-A1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2011-10-06 US disclosed
EP-2367794-A1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2011-09-28 EP disclosed
WO-2010057922-A1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2010-05-27 WO disclosed
WO-2010057922-A1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE BASF SE (DE) 2010-05-27 WO disclosed
US-20090215815-A1 Neurotrophin antagonist compositions PAINCEPTOR PHARMA CORPORATION (CA) 2009-08-27 US disclosed
US-20080287484-A1 Neurotrophin antagonist compositions TEHIM ASHOK 2008-11-20 US disclosed
US-20050065163-A1 Platelet adenosine diphosphate receptor antagonists SCHERING AKTIENGESELLSCHAFT (DE) 2005-03-24 US disclosed
WO-1998045283-A1 MICROBICIDAL BENZOTHIOPHENE S-OXIDE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1998-10-15 WO disclosed
EP-0656353-B1 Aminochinoline derivates useful in the treatment of malaria HOFFMANN LA ROCHE (CH) 1998-06-03 EP disclosed
US-5596002-A TREATMENT OF ANTIBIOTIC RESISTANT MICROORGANISMS HOFFMANN-LA ROCHE INC. (US) 1997-01-21 US disclosed
EP-0656353-A1 Aminochinoline derivates useful in the treatment of malaria F. HOFFMANN-LA ROCHE AG (CH) 1995-06-07 EP disclosed
US-4348398-A Quinolinyl ethanolamines MERCK SHARP & DOHME (I.A.) CORP. (US) 1982-09-07 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 (4 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-20050065163-A1 Platelet adenosine diphosphate receptor antagonists ADORA2B, ADORA1, TBXA2R KDM4E 4333/4885ALDH1A1 745/4885GAA 3605/4885
US-20110245375-A1 CURABLE COMPOSITION COMPRISING A THERMOLATENT BASE COIL, MAPT, ASH2L KDM4E 1082/4885ALDH1A1 2185/4885GAA 2430/4885
US-20090215815-A1 Neurotrophin antagonist compositions NGF, NTRK2, BDNF KDM4E 2061/4885ALDH1A1 1561/4885GAA 2404/4885
US-20080287484-A1 Neurotrophin antagonist compositions NGF, NTRK2, BDNF KDM4E 2031/4885ALDH1A1 1866/4885GAA 2460/4885

“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.