SCHEMBL860256

SCHEMBL860256

Oc1ccc(-c2nnco2)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 10/20 0.64
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 2/20 0.55
TLR8 Q9NR97 1/20 0.55
MAPT P10636 1/20 0.55
HTT P42858 1/20 0.55
TSHR P16473 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HPGD P15428 1/20 0.49
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 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
SCHEMBL6388915 0.89 TLR8 (0.73) NOTUMALDH1A1TLR8TSHRNPC1
SCHEMBL17694561 0.89 NOTUM (0.78) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL2610163 0.86 NOTUM (0.75) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL5571187 0.78 NOTUM (0.91) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL3685411 0.78 NOTUM (0.64) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL1194538 0.78 NOTUM (0.64) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL14814390 0.78 NOTUM (1.00) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL3537328 0.78 NOTUM (1.00) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL19356867 0.78 NOTUM (0.64) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL9096052 0.78 NOTUM (0.64) NOTUMKDM4EALDH1A1LMNATLR8

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 68 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0006712-B1 HETEROCYCLIC DERIVATIVES OF (4-ARYLOXYMETHYL-1.3-DIOXOLAN-2-YL) METHYL-1H-IMIDAZOLES AND -1H-1.2.4-TRIAZOLES, THEIR PREPARATION AND THE DERIVATIVES FOR USE AS FUNGICIDES AND BACTERICIDES JANSSEN PHARMACEUTICA N.V. (BE) 1983-11-30 EP claimed
EP-0006712-A1 Heterocyclic derivatives of (4-aryloxymethyl-1.3-dioxolan-2-yl) methyl-1H-imidazoles and -1H-1.2.4-triazoles, their preparation and the derivatives for use as fungicides and bactericides JANSSEN PHARMACEUTICA N.V. (BE) 1980-01-09 EP claimed
EP-3135669-B1 OXAZOLIDINE-BASED COMPOUND AND SELECTIVE ANDROGEN RECEPTOR AGONIST COMPRISING SAME DONG A ST CO LTD (KR) 2024-08-28 EP disclosed
US-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SOUTHERN RESEARCH INSTITUTE 2023-06-22 US disclosed
US-9809583-B2 Oxazolidine-based compound and selective androgen receptor agonist comprising same DONG-A ST CO., LTD. (KR) 2017-11-07 US disclosed
CN-106978193-A Flexure type liquid-crystal compounds and its synthetic method 华东理工大学 2017-07-25 CN disclosed
EP-3135669-A1 OXAZOLIDINE-BASED COMPOUND AND SELECTIVE ANDROGEN RECEPTOR AGONIST COMPRISING SAME Dong-A ST Co., Ltd. (KR) 2017-03-01 EP disclosed
US-20170050955-A1 OXAZOLIDINE-BASED COMPOUND AND SELECTIVE ANDROGEN RECEPTOR AGONIST COMPRISING SAME DONG-A ST CO., LTD. (KR) 2017-02-23 US disclosed
US-9149465-B2 Isoxazolines as inhibitors of fatty acid amide hydrolase INFINITY PHARMACEUTICALS, INC. (US) 2015-10-06 US disclosed
WO-2013059582-A2 SMALL MOLECULE INHIBITORS OF HISTONE DEACTEYLASES NUPOTENTIAL, INC. (US) 2013-04-25 WO disclosed
US-20120289540-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2012-11-15 US disclosed
EP-0034276-B1 PHENYLPIPERAZINE DERIVATIVES OF 1,3,4-OXADIAZOLYL PHENOLS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BASF Aktiengesellschaft (DE) 1983-11-09 EP disclosed
US-4353904-A TREATMENT OF HYPERTONIA BASF AKTIENGESELLSCHAFT (DE) 1982-10-12 US disclosed
US-4353904-A TREATMENT OF HYPERTONIA BASF AKTIENGESELLSCHAFT (DE) 1982-10-12 US disclosed
US-4353904-A TREATMENT OF HYPERTONIA BASF AKTIENGESELLSCHAFT (DE) 1982-10-12 US disclosed
EP-0056866-A2 Phenylpiperazine derivatives of heterylphenols and hetarylanilines, their preparation and their pharmaceutical compositions BASF Aktiengesellschaft (DE) 1982-08-04 EP disclosed
US-4313953-A BACTERICIDES, FUNGICIDES JANSSEN PHARMACEUTICA, N.V. (BE) 1982-02-02 US disclosed
EP-0034276-A2 Phenylpiperazine derivatives of 1,3,4-oxadiazolyl phenols, their preparation and pharmaceutical compositions containing them BASF Aktiengesellschaft (DE) 1981-08-26 EP disclosed
US-4218458-A FUNGICIDES, BACTERICIDES JANSSEN PHARMACEUTICA, N.V. (BE) 1980-08-19 US disclosed
EP-0006712-A1 Heterocyclic derivatives of (4-aryloxymethyl-1.3-dioxolan-2-yl) methyl-1H-imidazoles and -1H-1.2.4-triazoles, their preparation and the derivatives for use as fungicides and bactericides JANSSEN PHARMACEUTICA N.V. (BE) 1980-01-09 EP 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 (3 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-20120289540-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES BRAF, PRKDC, RAF1 NOTUM 2961/4885KDM4E 2009/4885ALDH1A1 1389/4885
US-20230192733-A1 SUBSTITUTED PHENYL ET458HYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS SARS1, ACE2, ACE NOTUM 1389/4885KDM4E 100/4885ALDH1A1 4373/4885
US-20170050955-A1 OXAZOLIDINE-BASED COMPOUND AND SELECTIVE ANDROGEN RECEPTOR AGONIST COMPRISING SAME AR, SHBG, MUSK NOTUM 1531/4885KDM4E 1579/4885ALDH1A1 1632/4885

“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.