SCHEMBL2860178

SCHEMBL2860178

O=[N+]([O-])c1ccc2c(Br)n[nH]c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.50
HPGD P15428 1/20 0.50
DAO P14920 1/20 0.50
CYP3A4 P08684 2/20 0.49
NOS1 P29475 2/20 0.49
LMNA P02545 1/20 0.49
ALOX15 P16050 1/20 0.49
PARP1 P09874 1/20 0.47
NAMPT P43490 1/20 0.46
XDH P47989 1/20 0.46
POLB P06746 2/20 0.45
MAOB P27338 1/20 0.45
GRIA1 P42261 1/20 0.45
GRIA2 P42262 1/20 0.45
GRIA3 P42263 1/20 0.45
GRIA4 P48058 1/20 0.45
MAP2K7 O14733 1/20 0.44
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
IDO1 P14902 2/20 0.43

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
SCHEMBL254651 0.87 MAPT (0.61) MAPTHPGDCYP3A4NOS1LMNA
SCHEMBL30235066 0.87 MAPT (0.61) MAPTHPGDCYP3A4NOS1LMNA
SCHEMBL2931498 0.81 JAK2 (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL29431208 0.81 JAK2 (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL30833662 0.81 DAO (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL921416 0.81 DAO (0.51) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL11145798 0.81 MAPT (0.58) MAPTHPGDDAONOS1LMNA
SCHEMBL4262245 0.81 PARP1 (0.49) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL4057244 0.81 PARP1 (0.53) MAPTHPGDDAOCYP3A4NOS1
SCHEMBL2926701 0.80 MAPT (0.50) MAPTHPGDDAOCYP3A4NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. 2024-05-30 US disclosed
WO-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 WO disclosed
US-20220324880-A1 SMARCA INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2022-10-13 US disclosed
CN-110546150-B Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof 江苏豪森药业集团有限公司 2021-12-21 CN disclosed
CN-109761986-B Tricyclic derivative inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2021-10-08 CN disclosed
US-20210238173-A1 MITOGEN-ACTIVATED PROTEIN KINASE KINASE 7 INHIBITORS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2021-08-05 US disclosed
CN-112236414-A Mitogen-activated protein kinase 7 inhibitors 耶达研究及发展有限公司 2021-01-15 CN disclosed
WO-2020251974-A1 SMARCA INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed
EP-3699179-A1 PYRAZOLYL-CONTAINING TRICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2020-08-26 EP disclosed
US-20200247815-A1 PYRAZOLYL-CONTAINING TRICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2020-08-06 US disclosed
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
CN-1300116-C 1H-indazole compounds EISAI CO LTD (JP) 2007-02-14 CN disclosed
US-7071182-B2 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2006-07-04 US disclosed
US-6982274-B2 1H-indazole compound EISAI CO., LTD. (JP) 2006-01-03 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 US disclosed
US-20050277638-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBVIE INC. 2005-12-15 US disclosed
US-20050137243-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES 2005-06-23 US disclosed
CN-1512987-A Novel 1H-indazole compound ������������ʽ���� 2004-07-14 CN disclosed
US-20040127538-A1 Novel 1h-indazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-07-01 US disclosed
EP-1380576-A1 NOVEL 1H-INDAZOLE COMPOUND Eisai Co., Ltd. (JP) 2004-01-14 EP 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 (8 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-20210238173-A1 MITOGEN-ACTIVATED PROTEIN KINASE KINASE 7 INHIBITORS MAPK7, MAP2K7, MAP3K7 MAPT 1774/4885HPGD 1266/4885DAO 1218/4885
US-20050137243-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MAPT 228/4885HPGD 2707/4885DAO 415/4885
US-20050277638-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MAPT 228/4885HPGD 2707/4885DAO 415/4885
US-20200247815-A1 PYRAZOLYL-CONTAINING TRICYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF MAPK1, MAPK11, MAPK14 MAPT 3727/4885HPGD 191/4885DAO 2790/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 MAPT 2892/4885HPGD 1866/4885DAO 915/4885
US-20220324880-A1 SMARCA INHIBITORS AND USES THEREOF SMARCA1, SMARCE1, PBRM1 MAPT 1576/4885HPGD 3740/4885DAO 3790/4885
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF LRRK2, MAP3K20, MAP3K5 MAPT 623/4885HPGD 3637/4885DAO 2262/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 MAPT 2644/4885HPGD 1817/4885DAO 3136/4885

“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.