SCHEMBL1019958

SCHEMBL1019958

Cc1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nc1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
ATM Q13315 1/20 0.67
MAPT P10636 7/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
ALDH1A1 P00352 4/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
HPGD P15428 1/20 0.58
SIRT6 Q8N6T7 2/20 0.57
LMNA P02545 3/20 0.57
ALOX12 P18054 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
GPR119 Q8TDV5 1/20 0.55
POLB P06746 2/20 0.54
ADRB1 P08588 1/20 0.50

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
SCHEMBL4430040 0.93 MEN1 (0.58) MEN1KMT2AATMMAPTSMN1; SMN2
SCHEMBL12240580 0.83 SIRT6 (0.74) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL8931734 0.83 MEN1 (0.62) MEN1KMT2AATMMAPTSMN1; SMN2
SCHEMBL1126953 0.81 MEN1 (0.64) MEN1KMT2AATMMAPTALDH1A1
SCHEMBL22495422 0.80 MEN1 (0.62) MEN1KMT2AATMMAPTSMN1; SMN2
SCHEMBL8931637 0.80 MEN1 (0.70) MEN1KMT2AATMMAPTSMN1; SMN2
SCHEMBL22495404 0.80 MEN1 (0.62) MEN1KMT2AATMMAPTALDH1A1
SCHEMBL22465858 0.80 KMT2A (1.00) MEN1KMT2AATMMAPTALDH1A1
SCHEMBL1126486 0.80 SIRT6 (0.56) MEN1KMT2AATMMAPTSMN1; SMN2
SCHEMBL3440078 0.79 MEN1 (0.77) MEN1KMT2AATMMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3728234-B1 RADIOLABELED COMPOUNDS HOFFMANN LA ROCHE (CH) 2025-05-14 EP disclosed
US-11541132-B2 Radiolabeled compounds HOFFMANN-LA ROCHE INC. (US) 2023-01-03 US disclosed
US-11541132-B2 Radiolabeled compounds HOFFMANN-LA ROCHE INC. (US) 2023-01-03 US disclosed
EP-3728234-A1 RADIOLABELED COMPOUNDS F. Hoffmann-La Roche AG (CH) 2020-10-28 EP disclosed
US-20200316232-A1 RADIOLABELED COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2020-10-08 US disclosed
US-20200316232-A1 RADIOLABELED COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2020-10-08 US disclosed
CN-111511732-A Radiolabelled compounds 豪夫迈·罗氏有限公司 2020-08-07 CN disclosed
EP-2173749-B1 2-OXO-2- (2-PHENYL-5,6,7,8-TETRAHYDRO-INDOLIZIN-3-YL) -ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ANTIFUNGAL AGENTS F2G LTD (GB) 2011-01-12 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 (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-11541132-B2 Radiolabeled compounds SNCA, APP, BACE1 MEN1 311/4885KMT2A 4463/4885ATM 3155/4885
US-20200316232-A1 RADIOLABELED COMPOUNDS SNCA, APP, BACE1 MEN1 326/4885KMT2A 4496/4885ATM 3273/4885

“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.