SCHEMBL1929353

SCHEMBL1929353

ClCCOc1ccccc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.58
RAB9A P51151 5/20 0.50
LMNA P02545 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 4/20 0.49
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 6/20 0.47
MAPT P10636 5/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
HPGD P15428 1/20 0.47
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 3/20 0.45
TDP1 Q9NUW8 1/20 0.45
MEN1 O00255 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45

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
SCHEMBL5661298 0.91 HTR7 (0.58) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL10798879 0.86 HTR7 (0.67) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL2344935 0.84 HTR7 (0.64) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL701534 0.84 HTR7 (0.64) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL6848695 0.84 KDM4E (0.54) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL4486844 0.82 HTR7 (0.52) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL29894494 0.82 HTR7 (0.52) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL30883281 0.82 HTR7 (0.62) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL28912859 0.82 MRGPRX4 (0.47) HTR7RAB9ALMNASMN1; SMN2NPC1
SCHEMBL25384506 0.80 HTR7 (0.40) HTR7RAB9ALMNASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023070907-A1 ETHERIFICATION METHOD FOR HALOGENATED PHENOL 台州学院 2023-05-04 WO disclosed
CN-113896618-A Etherification method of halogenated phenol 台州学院 2022-01-07 CN disclosed
CN-101166742-B Novel lactam compound AJINOMOTO KK 2011-07-13 CN disclosed
US-20110152234-A1 Novel Compounds ASTRAZENECA AB (SE) 2011-06-23 US disclosed
US-7956084-B2 Phenyl thiophene carboxamide compounds as inhibitors of the enzyme IKK-2 ASTRAZENECA AB (SE) 2011-06-07 US disclosed
EP-1421074-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2010-09-29 EP disclosed
EP-2229377-A1 5-ALKYL/ALKENYL-3-CYANOPYRIDINES AS KINASE INHIBITORS Wyeth LLC (US) 2010-09-22 EP disclosed
US-20090215829-A1 THIOPHENE CARBOXAMIDES AS INHIBITORS OF THE ENZYME IKK-2 MORLEY ANDREW DAVID 2009-08-27 US disclosed
US-7553868-B2 Thiophene carboxamides as inhibitors of the enzyme IKK-2 ASTRAZENECA AB (SE) 2009-06-30 US disclosed
WO-2009076602-A1 5-ALKYL/ALKENYL-3-CYANOPYRIDINES AS KINASE INHIBITORS WYETH (US) 2009-06-18 WO disclosed
EP-1583756-A1 THIOPHENE CARBOXAMIDES AS INHIBITORS OF THE ENZYME IKK-2 AstraZeneca AB (SE) 2005-10-12 EP disclosed
US-20040242573-A1 Novel compounds ASTRAZENECA AB (SE) 2004-12-02 US disclosed
CN-1541214-A Novel compounds 2004-10-27 CN disclosed
WO-2004063185-A1 THIOPHENE CARBOXAMIDES AS INHIBITORS OF THE ENZYME IKK-2 ASTRAZENECA AB (SE) 2004-07-29 WO disclosed
EP-1421074-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2004-05-26 EP disclosed
EP-1370562-A1 THIENO[2,3-D]PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-12-17 EP disclosed
WO-2003095441-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2003-11-20 WO disclosed
WO-2003010158-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2003-02-06 WO disclosed
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 US disclosed
WO-2002064598-A1 THIENO'2,3-D PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 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 (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-20090215829-A1 THIOPHENE CARBOXAMIDES AS INHIBITORS OF THE ENZYME IKK-2 RELA, NFKBIA, CSNK1E HTR7 3100/4885RAB9A 4041/4885LMNA 3926/4885
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors MMP13, MMP3, MMP25 HTR7 1799/4885RAB9A 2581/4885LMNA 1210/4885
US-20040242573-A1 Novel compounds SULT1E1, TPMT, UGT1A1 HTR7 1222/4885RAB9A 319/4885LMNA 3431/4885
US-20110152234-A1 Novel Compounds CNR1, ABCG2, CNR2 HTR7 1366/4885RAB9A 1662/4885LMNA 3591/4885

“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.