SCHEMBL4062158

SCHEMBL4062158

CNC(=O)c1ccccc1I

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
GAA P10253 1/20 0.59
PLK1 P53350 2/20 0.55
PARP1 P09874 1/20 0.44
BRD4 O60885 2/20 0.43
KAT2B Q92831 1/20 0.42
BAZ2B Q9UIF8 1/20 0.42
BRD2 P25440 1/20 0.42
BRD3 Q15059 1/20 0.42
BRDT Q58F21 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
POLB P06746 1/20 0.42
TP53 P04637 1/20 0.42
MAPK10 P53779 1/20 0.41

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
SCHEMBL2344909 0.84 GAA (0.71) KMT2AGAAPLK1BRD4KAT2B
SCHEMBL24616780 0.80 PLK1 (0.49) KMT2AMEN1TDP1GAAPLK1
SCHEMBL27583795 0.80 MEN1 (0.62) KMT2AMEN1TDP1GAAPARP1
SCHEMBL28415607 0.79 MEN1 (0.56) KMT2AMEN1TDP1PARP1POLB
SCHEMBL23367889 0.79 KMT2A (0.61) KMT2AMEN1TDP1GAAPARP1
Dimethylamine SCHEMBL1168842 0.78 KMT2A (0.55) KMT2AMEN1TDP1GAAPOLB
SCHEMBL2293802 0.78 MEN1 (0.60) KMT2AMEN1TDP1GAAPARP1
SCHEMBL6958929 0.78 MEN1 (0.60) KMT2AMEN1TDP1GAAPARP1
SCHEMBL4352870 0.78 KMT2A (0.55) KMT2AMEN1TDP1BRD4
SCHEMBL6740430 0.78 MEN1 (0.55) KMT2AMEN1TDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113548948-B Preparation method of methyl octabromoether 宿迁联盛科技股份有限公司 2023-04-14 CN claimed
CN-120004754-A Preparation method of high-purity N-methyl halogenated benzamide 福州大学 2025-05-16 CN disclosed
CN-116535344-B Phthalimide preparation method of class compound 华南理工大学 2024-10-01 CN disclosed
US-20230346753-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT VALO HEALTH, INC. 2023-11-02 US disclosed
EP-3480187-B1 METHOD FOR PREPARING INDENOISOQUINOLINE DERIVATIVES UNIV NAT TAIWAN NORMAL (TW) 2023-10-04 EP disclosed
CN-116535344-A Preparation method of phthalimide compound 华南理工大学 2023-08-04 CN disclosed
CN-113548948-B Preparation method of methyl octabromoether 宿迁联盛科技股份有限公司 2023-04-14 CN disclosed
US-11274106-B2 Topoisomerase inhibitors with antibacterial and anticancer activity THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2022-03-15 US disclosed
WO-2021028935-A1 HETEROCYCLIC COMPOUNDS, AND THEIR USE AS ALLOSTERIC MODULATORS OF 5-HYDROXYTRYPTAMINE 2C RECEPTOR (5-HT2CR) DR REDDY'S INSTITUTE OF LIFE SCIENCES (IN) 2021-02-18 WO disclosed
WO-2020219650-A1 DEGRADERS OF CYCLIN-DEPENDENT KINASE 12 (CDK12) AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-10-29 WO disclosed
EP-1893596-A2 BENZOÝB¨FURANE AND BENZOÝB¨THIOPHENE DERIVATIVES H.Lundbeck A/S (DK) 2008-03-05 EP disclosed
US-20070276016-A1 BENZO[1,2,5]THIADIAZOLE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-29 US disclosed
US-7241759-B2 Benzo[1,2,5]thiadiazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-10 US disclosed
WO-2007023395-A2 BENZO[B]FURANE AND BENZO[B]THIOPHENE DERIVATIVES H. LUNDBECK A/S (US) 2007-03-01 WO disclosed
US-20060287386-A1 Benzo[b]furane and benzo[b]thiophene derivatives H. LUNDBECK A/S (DK) 2006-12-21 US disclosed
US-6967196-B1 Sulfonamide compounds and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-22 US disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
EP-0859757-A1 DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS Farmak A.S. (CZ) 1998-08-26 EP disclosed
WO-1997017325-A1 DERIVATES OF N,N-DIMETHYL-2-(ARYLTHIO)BENZYLAMINE, THEIR SALTS, METHODS OF PREPARATION AND THEIR USE IN PHARMACEUTICAL MEDICAMENTS FARMAK A.S. (CZ) 1997-05-15 WO disclosed
US-4279887-A RADIOACTIVE SCANNING MEDI-PHYSICS, INC. (US) 1981-07-21 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 (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-20060287386-A1 Benzo[b]furane and benzo[b]thiophene derivatives CYP1B1, TBCB, CYP4B1 KMT2A 3617/4885MEN1 2561/4885TDP1 1262/4885
US-20070276016-A1 BENZO[1,2,5]THIADIAZOLE COMPOUNDS CCKBR, CCKAR, GIPR KMT2A 3053/4885MEN1 2768/4885TDP1 3185/4885
US-11274106-B2 Topoisomerase inhibitors with antibacterial and anticancer activity TOP2A, TOP1, TOP2B KMT2A 1764/4885MEN1 1730/4885TDP1 37/4885
US-20230346753-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT NAMPT, NNMT, NQO1 KMT2A 1615/4885MEN1 582/4885TDP1 3947/4885

“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.