SCHEMBL267964

SCHEMBL267964

COC(=O)c1nc(N)ccc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.48
NOS3 P29474 1/20 0.45
NOS1 P29475 1/20 0.45
NOS2 P35228 1/20 0.45
KDM4E B2RXH2 9/20 0.43
ALDH1A1 P00352 8/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
HSD17B10 Q99714 4/20 0.43
HPGD P15428 2/20 0.43
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42
GABRA4 P48169 1/20 0.42

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
SCHEMBL29756221 1.00 NPSR1 (0.48) NPSR1NOS3NOS1NOS2KDM4E
SCHEMBL28033848 0.82 ALDH1A1 (0.49) NOS3NOS1NOS2KDM4EALDH1A1
SCHEMBL31252858 0.81 NPSR1 (0.48) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL8320350 0.81 NPSR1 (0.48) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL1428189 0.81 NPSR1 (0.48) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL2372967 0.81 NPSR1 (0.52) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL25359629 0.80 NPSR1 (0.47) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL15390591 0.80 KDM4E (0.50) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL1268827 0.80 NPSR1 (0.47) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL29549957 0.79 NPSR1 (0.50) NPSR1KDM4EALDH1A1SMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4293029-B1 AZAHETEROARYL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SHANGHAI BLUERAY BIOPHARMA CO LTD (CN) 2025-12-17 EP disclosed
US-20240182492-A1 AZAHETEROARYL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF SHANGHAI BLUERAY BIOPHARMA CO., LTD. (CN) 2024-06-06 US disclosed
CN-116888125-B TYK2 inhibitor and application thereof 上海齐鲁制药研究中心有限公司 2024-04-12 CN disclosed
EP-4293029-A1 AZAHETEROARYL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Shanghai Blueray Biopharma Co., Ltd. (CN) 2023-12-20 EP disclosed
CN-116888125-A TYK2 inhibitor and application thereof 上海齐鲁制药研究中心有限公司 2023-10-13 CN disclosed
WO-2022171166-A1 AZAHETEROARYL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 上海青煜医药科技有限公司 2022-08-18 WO disclosed
EP-2531503-A1 GAMMA SECRETASE MODULATERS F. Hoffmann-La Roche AG (CH) 2012-12-12 EP disclosed
US-8134007-B2 Pyridine derivatives PFIZER INC. (US) 2012-03-13 US disclosed
WO-2011092272-A1 GAMMA SECRETASE MODULATERS F. HOFFMANN-LA ROCHE AG (CH) 2011-08-04 WO disclosed
US-20110190269-A1 GAMMA SECRETASE MODULATORS HOFFMANN-LA ROCHE, INC. 2011-08-04 US disclosed
US-20090048306-A1 PYRIDINE DERIVATIVES PFIZER, INC. (US) 2009-02-19 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 (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-20240182492-A1 AZAHETEROARYL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF EZH2, EED, EZH1 NPSR1 3315/4885NOS3 4347/4885NOS1 3800/4885
US-20110190269-A1 GAMMA SECRETASE MODULATORS BACE1, APH1A, APH1B NPSR1 933/4885NOS3 1474/4885NOS1 1444/4885
US-20090048306-A1 PYRIDINE DERIVATIVES SDHA, P2RX4, P2RX3 NPSR1 321/4885NOS3 759/4885NOS1 1165/4885

“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.