SCHEMBL844331

SCHEMBL844331

COC(=O)c1cc(CBr)ccc1Cl

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.72
CYP4A11 Q02928 2/20 0.72
ALDH1A1 P00352 4/20 0.50
TSHR P16473 3/20 0.50
LMNA P02545 6/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HPGD P15428 4/20 0.49
MAPT P10636 3/20 0.49
KDM4E B2RXH2 2/20 0.49
GAA P10253 1/20 0.49
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ABL1 P00519 1/20 0.42
CASR P41180 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
SCHEMBL30750476 1.00 CYP4F2 (0.72) CYP4F2CYP4A11ALDH1A1TSHRLMNA
Hydrochloric Acid SCHEMBL25290200 0.91 CYP4F2 (0.62) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL27945518 0.87 CYP4F2 (0.56) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL1830479 0.87 CYP4F2 (0.55) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL12332820 0.86 CYP4F2 (0.58) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL844371 0.84 CYP4F2 (0.57) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL1022658 0.84 ALDH1A1 (0.53) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL29943277 0.84 ALDH1A1 (0.53) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL787287 0.84 CYP4F2 (0.59) CYP4F2CYP4A11ALDH1A1TSHRLMNA
SCHEMBL31312075 0.84 CYP4F2 (0.59) CYP4F2CYP4A11ALDH1A1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250059172-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL NIPPON SHINYAKU CO., LTD. (JP) 2025-02-20 US disclosed
US-12187728-B2 Caffeine inhibitors of MTHFD2 and uses thereof RAZE THERAPEUTICS, INC. (US) 2025-01-07 US disclosed
EP-4458810-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL Nippon Shinyaku Co., Ltd. (JP) 2024-11-06 EP disclosed
US-20240343740-A1 MACROCYCLIC GLUCAGON-LIKE PEPTIDE 1 RECEPTOR AGONISTS ELI LILLY AND COMPANY 2024-10-17 US disclosed
EP-3962915-B1 SELECTIVE LIGANDS OF HUMAN CONSTITUTIVE ANDROSTANE RECEPTOR USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR V V I (CZ) 2024-09-04 EP disclosed
EP-4341255-A1 MACROCYCLIC GLUCAGON-LIKE PEPTIDE 1 RECEPTOR AGONISTS Eli Lilly and Company (US) 2024-03-27 EP disclosed
CN-117355517-A Macrocyclic glucagon-like peptide 1 receptor agonists 伊莱利利公司 2024-01-05 CN disclosed
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF RAZE THERAPEUTICS, INC. 2023-03-02 US disclosed
WO-2022246019-A1 MACROCYCLIC GLUCAGON-LIKE PEPTIDE 1 RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2022-11-24 WO disclosed
US-11370792-B2 Caffeine inhibitors of MTHFD2 and uses thereof RAZE THERAPEUTICS, INC. (US) 2022-06-28 US disclosed
US-7622612-B2 Tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2009-11-24 US disclosed
US-7622612-B2 Tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2009-11-24 US disclosed
US-20090270359-A1 SUBSTITUTED PYRAZOLE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-29 US disclosed
US-20080176906-A1 Substituted Pyrrole Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 US disclosed
US-20080176906-A1 Substituted Pyrrole Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 US disclosed
US-20080176906-A1 Substituted Pyrrole Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-24 US disclosed
EP-1824841-A1 SUBSTITUTED PYRROLE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2007-08-29 EP disclosed
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 US disclosed
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 US disclosed
WO-2006064944-A1 SUBSTITUTED PYRROLE DERIVATIVE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-22 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 (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-12187728-B2 Caffeine inhibitors of MTHFD2 and uses thereof MTHFD2, MTHFD1, NUDT15 CYP4F2 33/4885CYP4A11 1190/4885ALDH1A1 260/4885
US-20240343740-A1 MACROCYCLIC GLUCAGON-LIKE PEPTIDE 1 RECEPTOR AGONISTS GLP1R, GCGR, GIPR CYP4F2 4138/4885CYP4A11 1593/4885ALDH1A1 3937/4885
US-20250059172-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL MC5R, CYP3A5, PTGIS CYP4F2 669/4885CYP4A11 392/4885ALDH1A1 889/4885
US-20070021427-A1 Novel tricyclic derivatives and their use NFATC1, IL2, CCL2 CYP4F2 2154/4885CYP4A11 1013/4885ALDH1A1 2078/4885
US-11370792-B2 Caffeine inhibitors of MTHFD2 and uses thereof MTHFD2, MTHFD1, NUDT15 CYP4F2 33/4885CYP4A11 1190/4885ALDH1A1 260/4885
US-20230067237-A1 CAFFEINE INHIBITORS OF MTHFD2 AND USES THEREOF MTHFD2, MTHFD1, NUDT15 CYP4F2 33/4885CYP4A11 1190/4885ALDH1A1 260/4885
US-20090270359-A1 SUBSTITUTED PYRAZOLE DERIVATIVES AR, NR5A1, NR3C2 CYP4F2 577/4885CYP4A11 84/4885ALDH1A1 816/4885
US-20080176906-A1 Substituted Pyrrole Derivative AR, NR5A1, MC2R CYP4F2 967/4885CYP4A11 92/4885ALDH1A1 408/4885

“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.