SCHEMBL4556786

SCHEMBL4556786

COC(=O)c1cccnc1CBr

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
PKM P14618 1/20 0.51
MAP2K1 Q02750 1/20 0.50
KDM4E B2RXH2 6/20 0.49
POLB P06746 2/20 0.47
ATM Q13315 1/20 0.47
ALDH1A1 P00352 5/20 0.46
LMNA P02545 3/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 2/20 0.45
ALOX15 P16050 1/20 0.45
CNR2 P34972 1/20 0.45
CFTR P13569 1/20 0.44
MAPK10 P53779 1/20 0.44
P2RX7 Q99572 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL29361610 1.00 TDP1 (0.53) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL27497541 0.89 TDP1 (0.49) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL6017355 0.88 TDP1 (0.54) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL30798461 0.86 TDP1 (0.53) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL4074618 0.86 TDP1 (0.53) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL242591 0.85 TDP1 (0.51) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL22912507 0.85 TDP1 (0.51) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL29363643 0.85 TDP1 (0.51) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL16790454 0.85 TDP1 (0.51) TDP1L3MBTL1PKMMAP2K1KDM4E
SCHEMBL1542171 0.83 TSHR (0.58) L3MBTL1ALDH1A1TSHRHSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479858-B2 Macrocyclic compounds as sting agonists and methods and uses thereof LUPIN LIMITED (IN) 2025-11-25 US disclosed
US-12448368-B2 Indole compounds as androgen receptor modulators NIDO BIOSCIENCES, INC. (US) 2025-10-21 US disclosed
US-20250230168-A1 AZASPIRO WRN INHIBITORS GILEAD SCIENCES, INC. 2025-07-17 US disclosed
WO-2025137640-A1 AZASPIRO WRN INHIBITORS GILEAD SCIENCES, INC. (US) 2025-06-26 WO disclosed
US-20250122176-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES INC (US) 2025-04-17 US disclosed
US-20250092021-A9 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. 2025-03-20 US disclosed
EP-4004002-B1 MACROCYCLIC COMPOUNDS AS STING AGONISTS AND METHODS AND USES THEREOF LUPIN LTD (IN) 2024-07-10 EP disclosed
EP-4004002-B1 MACROCYCLIC COMPOUNDS AS STING AGONISTS AND METHODS AND USES THEREOF LUPIN LTD (IN) 2024-07-10 EP disclosed
CN-114174303-B Macrocyclic compounds as STING agonists and methods and uses thereof 印度鲁宾有限公司 2024-06-25 CN disclosed
US-20240109899-A1 BENZOFURAN COMPOUNDS AS STING AGONISTS BRISTOL-MYERS SQUIBB COMPANY (US) 2024-04-04 US disclosed
US-8772304-B2 Benzimidazole inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-08 US disclosed
US-20120277227-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-01 US disclosed
US-20120277227-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-11-01 US disclosed
WO-2012061169-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-10 WO disclosed
US-20060275217-A1 Chemical exchange saturation transfer contrast agents EPIX PHARMACEUTICALS, INC. 2006-12-07 US disclosed
WO-2006121889-A2 CHEMICAL EXCHANGE SATURATION TRANSFER CONTRAST AGENTS EPIX PHARMACEUTICALS, INC. (US) 2006-11-16 WO disclosed
US-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US disclosed
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO disclosed
EP-0888347-A1 PHARMACEUTICALLY USEFUL COMPOUNDS Astra Pharmaceuticals Limited (GB) 1999-01-07 EP disclosed
WO-1997034893-A1 PHARMACEUTICALLY USEFUL COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-09-25 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 (9 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-20250230168-A1 AZASPIRO WRN INHIBITORS WRN, RECQL, BLM TDP1 54/4885L3MBTL1 3352/4885PKM 3939/4885
US-12479858-B2 Macrocyclic compounds as sting agonists and methods and uses thereof STING1, CGAS, MAVS TDP1 251/4885L3MBTL1 4124/4885PKM 2524/4885
US-20250122176-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 TDP1 1621/4885L3MBTL1 3975/4885PKM 1672/4885
US-20250092021-A9 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 TDP1 1621/4885L3MBTL1 3975/4885PKM 1672/4885
US-12448368-B2 Indole compounds as androgen receptor modulators AR, FSHR, ADRB3 TDP1 1371/4885L3MBTL1 3847/4885PKM 1534/4885
US-20060275217-A1 Chemical exchange saturation transfer contrast agents SLC39A11, SLC30A7, SLC39A7 TDP1 3736/4885L3MBTL1 809/4885PKM 2091/4885
US-20240109899-A1 BENZOFURAN COMPOUNDS AS STING AGONISTS STING1, MAVS, IRF3 TDP1 262/4885L3MBTL1 3230/4885PKM 2723/4885
US-20120277227-A1 BENZIMIDAZOLE INHIBITORS OF LEUKOTRIENE PRODUCTION LTC4S, LTB4R, LTB4R2 TDP1 4210/4885L3MBTL1 693/4885PKM 1201/4885
US-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD TDP1 3080/4885L3MBTL1 790/4885PKM 171/4885

“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.