SCHEMBL1775346

SCHEMBL1775346

CC(C)(C)OC(=O)N1CCN(c2ccnc3ccc(Br)cc23)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 2/20 0.56
BACE1 P56817 4/20 0.50
IDE P14735 2/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAP4K4 O95819 1/20 0.46
CLK1 P49759 1/20 0.46
ACHE P22303 2/20 0.44
GPR119 Q8TDV5 1/20 0.43
POLB P06746 1/20 0.43
KIT P10721 1/20 0.43
SMARCA2 P51531 1/20 0.43
SMARCA4 P51532 1/20 0.43
PBRM1 Q86U86 1/20 0.43
PDGFRB P09619 1/20 0.43
CKS1B P61024 1/20 0.43
SKP1 P63208 1/20 0.43
SKP2 Q13309 1/20 0.43
CCR5 P51681 1/20 0.42
ALDH1A1 P00352 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
SCHEMBL1776376 0.96 NCF1 (0.52) NCF1BACE1IDEMEN1KMT2A
SCHEMBL30495380 0.86 IDO1 (0.53) IDEMEN1KMT2AMAP4K4CLK1
SCHEMBL17729235 0.86 IDO1 (0.53) IDEMEN1KMT2AMAP4K4CLK1
SCHEMBL7467892 0.86 MAP4K4 (0.51) IDEMEN1KMT2AMAP4K4CLK1
SCHEMBL1299882 0.84 IDE (0.47) NCF1IDEMEN1KMT2AMAP4K4
SCHEMBL1300018 0.84 IDE (0.50) IDEMEN1KMT2AMAP4K4CLK1
SCHEMBL1300380 0.84 IDE (0.48) NCF1IDEMEN1KMT2AMAP4K4
SCHEMBL17579072 0.84 BACE1 (0.50) BACE1MEN1KMT2AMAP4K4GPR119
SCHEMBL2422976 0.83 PDGFRB (0.55) NCF1IDEMEN1KMT2ACLK1
SCHEMBL25388732 0.83 BACE1 (0.49) BACE1MAP4K4GPR119KITSMARCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024188229-A1 SALT FORM AND CRYSTAL FORM OF QUINAZOLINE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川汇宇制药股份有限公司 2024-09-19 WO disclosed
WO-2023165581-A1 PYRIDINE DERIVATIVE AND USE THEREOF 四川汇宇制药股份有限公司 2023-09-07 WO disclosed
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
EP-2048142-A2 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof Eisai R&D Management Co., Ltd. (JP) 2009-04-15 EP disclosed
EP-1382603-B1 NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF EISAI R&D MAN CO LTD (JP) 2008-07-23 EP disclosed
EP-1897876-A2 Compounds useful for the treatment of obesity, type II diabetes and CNS disorders Biovitrum AB (publ) (SE) 2008-03-12 EP disclosed
CN-101081845-A Substituted sulphone and sulphonamide compounds useful for the treatment of obesity, type II diabetes and cns disorders BIOVITRUM AB (SE) 2007-12-05 CN disclosed
CN-1907982-A New compounds useful for the treatment of obesity,type II diabetes and CNS disorders BIOVITRUM AB (SE) 2007-02-07 CN disclosed
US-7074801-B1 Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof EISAI CO., LTD. (JP) 2006-07-11 US disclosed
CN-1662521-A Novel compounds useful for the treatment of obesity, type II diabetes and CNS disorders BIOVITRUM AB (SE) 2005-08-31 CN disclosed
EP-1513828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS Biovitrum AB (SE) 2005-03-16 EP disclosed
US-20040024210-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-05 US disclosed
EP-1382603-A1 NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF Eisai Co., Ltd. (JP) 2004-01-21 EP disclosed
WO-2004000828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS BIOVITRUM AB (SE) 2003-12-31 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 (1 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-20040024210-A1 New compounds SULT1E1, SULT2A1, SULT1A1 NCF1 3776/4885BACE1 1765/4885IDE 1424/4885

“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.