SCHEMBL7409559

SCHEMBL7409559

Nc1cc(F)cc(Br)c1I

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.34
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
POLB P06746 1/20 0.31
THRB P10828 1/20 0.31
NR4A1 P22736 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
PTPN11 Q06124 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL31614683 1.00 GAA (0.34) GAAMAPTKMT2AALDH1A1MEN1
SCHEMBL1393362 0.82 GAA (0.35) GAAMAPTKMT2A
SCHEMBL29920955 0.75 MAPT (0.37) GAAMAPTKMT2AALDH1A1
SCHEMBL29674966 0.75 MAPT (0.43) GAAMAPTKMT2AALDH1A1MEN1
SCHEMBL29851037 0.75 GAA (0.36) GAAMAPTKMT2AALDH1A1MEN1
SCHEMBL9391171 0.75 MAPT (0.43) GAAMAPTKMT2AALDH1A1MEN1
SCHEMBL418340 0.75 MAPT (0.43) GAAMAPTKMT2AALDH1A1MEN1
SCHEMBL7643820 0.75 CYP3A4 (0.38) GAAMAPTKMT2APOLBL3MBTL1
SCHEMBL1494366 0.75 GAA (0.36) GAAMAPTKMT2AALDH1A1MEN1
SCHEMBL4607963 0.75 MAPT (0.37) GAAMAPTKMT2AALDH1A1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250186425-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS INC. 2025-06-12 US disclosed
EP-4490147-A1 PPARG INVERSE AGONISTS AND USES THEREOF Flare Therapeutics Inc. (US) 2025-01-15 EP disclosed
CN-118984823-A PPARG inverse agonists and uses thereof 弗拉雷治疗公司 2024-11-19 CN disclosed
US-20240336594-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF BETTA PHARMACEUTICALS CO., LTD (CN) 2024-10-10 US disclosed
EP-4368618-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF Betta Pharmaceuticals Co., Ltd (CN) 2024-05-15 EP disclosed
CN-117715898-A Six-membered aryl or heteroaryl amide compound, composition and application thereof 贝达药业股份有限公司 2024-03-15 CN disclosed
WO-2023172845-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS INC. (US) 2023-09-14 WO disclosed
WO-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 WO disclosed
WO-2023279986-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF 贝达药业股份有限公司 2023-01-12 WO disclosed
US-5547991-A NMDA antagonism method MERRELL PHARMACEUTICALS INC. (US) 1996-08-20 US disclosed
US-5484814-A NMDA antagonists MERRELL DOW PHARMACEUTICALS INC. (US) 1996-01-16 US disclosed
US-5470870-A New class of excitatory amino acid antagonist for epilepsy, anxiety or stroke MERRELL DOW PHARMACEUTICALS INC. (US) 1995-11-28 US disclosed
EP-0501378-B1 NMDA Antagonists MERRELL DOW PHARMA (US) 1995-01-11 EP disclosed
US-5360814-A NMDA antagonists MERRELL DOW PHARMACEUTICALS INC. (US) 1994-11-01 US disclosed
EP-0501378-A1 NMDA Antagonists MERRELL DOW PHARMACEUTICALS INC. (US) 1992-09-02 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 (2 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-20250186425-A1 PPARG INVERSE AGONISTS AND USES THEREOF PPARG, PPARA, PPARD GAA 2455/4885MAPT 4588/4885KMT2A 4230/4885
US-20240336594-A1 SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF MALT1, CYP51A1, BCR GAA 75/4885MAPT 1950/4885KMT2A 979/4885

“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.