SCHEMBL2803033

SCHEMBL2803033

COc1ccc(Br)c(I)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.43
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ CA7 P43166 2/20 0.43
▸ CA9 Q16790 2/20 0.43
▸ CA14 Q9ULX7 2/20 0.43
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ ACHE P22303 3/20 0.39
▸ BACE1 P56817 1/20 0.39
▸ ALDH1A1 P00352 6/20 0.39
▸ MAPT P10636 4/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ THRB P10828 2/20 0.38
▸ NPC1 O15118 2/20 0.38

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
SCHEMBL3516667 0.84 CA1 (0.46) CA12CA1CA2CA7CA9
SCHEMBL30777888 0.84 CA1 (0.46) CA12CA1CA2CA7CA9
SCHEMBL1134723 0.80 CA1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL30250475 0.80 CA1 (0.53) CA12CA1CA2CA7CA9
SCHEMBL30548757 0.78 CA1 (0.50) CA12CA1CA2CA7CA9
SCHEMBL4992020 0.78 CA1 (0.50) CA12CA1CA2CA7CA9
SCHEMBL23887132 0.78 SMN1; SMN2 (0.35) ACHEBACE1ALDH1A1MAPTMEN1
SCHEMBL29792960 0.78 ALDH1A1 (0.41) CA12CA1CA2CA7CA9
SCHEMBL30176397 0.78 SMN1; SMN2 (0.35) ACHEBACE1ALDH1A1MAPTMEN1
SCHEMBL6322208 0.77 NQO1 (0.50) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260015335-A1 AMINE-SUBSTITUTED FLUORESCENT COMPOUNDS HUGHES HOWARD MED INST (US) 2026-01-15 — — US disclosed
US-20260001857-A1 FLUORINATED FLUORESCENT COMPOUNDS HUGHES HOWARD MED INST (US) 2026-01-01 — — US disclosed
US-20250282744-A1 RED-SHIFTED FLUOROPHORES HOWARD HUGHES MEDICAL INSTITUTE 2025-09-11 — — US disclosed
US-12344594-B2 Red-shifted fluorophores HOWARD HUGHES MEDICAL INSTITUTE (US) 2025-07-01 — — US disclosed
CN-119909072-A Use of benzofuro [3,2-c ] quinolinone compounds for preventing and treating steatohepatitis related to metabolic dysfunction 中国人民解放军空军军医大学 2025-05-02 — — CN disclosed
US-20250026721-A1 COMPOUNDS AND METHODS FOR MODULATING RAS-PI3K VIVIDION THERAPEUTICS, INC. 2025-01-23 — — US disclosed
CN-118619932-A GPR40 agonist and preparation method and application thereof 广东众生睿创生物科技有限公司 2024-09-10 — — CN disclosed
CN-116478183-A Difunctional, reversible, quantitative and Golgi targeted fluorescent probe for monitoring intracellular redox steady state dynamics in real time 中南大学 2023-07-25 — — CN disclosed
US-20230219988-A1 ORGANOMETALLIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-13 — — US disclosed
US-20230219988-A1 ORGANOMETALLIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-13 — — US disclosed
US-20100184800-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-07-22 — — US disclosed
WO-2010030538-A2 COMPOUNDS FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY (US) 2010-03-18 — — WO disclosed
US-20100063068-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-03-11 — — US disclosed
US-20100063068-A1 Compounds for the Treatment of Hepatitis C BRISTOL-MYERS SQUIBB COMPANY 2010-03-11 — — US disclosed
EP-2069324-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS Curis, Inc. (US) 2009-06-17 — — EP disclosed
WO-2008115719-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS, INC. (US) 2008-09-25 — — WO disclosed
US-20080234314-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS, INC. 2008-09-25 — — US disclosed
EP-1778632-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-08-20 — — EP disclosed
EP-0049913-A2 New ethenylimidazole derivatives, processes for their preparation and pharmaceutical compositions containing them; intermediates, useful in their preparation and a process for the preparation thereof GIST-BROCADES N.V. (NL) 1982-04-21 — — EP disclosed
US-4064139-A TRANQUILIZERS, ANTICONVULSANTS, MUSCLE RELAXANTS, ANTI-PARKINSON'S DISEASE MERCK & CO., INC. (US) 1977-12-20 — — 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 (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-12344594-B2 Red-shifted fluorophores TFEB, DDX21, CDC73 CA12 3224/4885CA1 3712/4885CA2 3602/4885
US-20250026721-A1 COMPOUNDS AND METHODS FOR MODULATING RAS-PI3K KRAS, HRAS, NRAS CA12 4224/4885CA1 4347/4885CA2 3649/4885
US-20250282744-A1 RED-SHIFTED FLUOROPHORES TFEB, DDX21, CDC73 CA12 3226/4885CA1 3719/4885CA2 3606/4885
US-20260001857-A1 FLUORINATED FLUORESCENT COMPOUNDS MSN, CHN2, EFHD2 CA12 1656/4885CA1 2272/4885CA2 1664/4885
US-20260015335-A1 AMINE-SUBSTITUTED FLUORESCENT COMPOUNDS AOC2, H1-2, CHAT CA12 1648/4885CA1 2318/4885CA2 1614/4885
US-20100063068-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 CA12 1432/4885CA1 4156/4885CA2 4160/4885
US-20100184800-A1 Compounds for the Treatment of Hepatitis C HAVCR2, HCCS, SLC10A1 CA12 1432/4885CA1 4156/4885CA2 4160/4885
US-20230219988-A1 ORGANOMETALLIC COMPOUND, LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE LAGE3, GPX1, CRY1 CA12 2081/4885CA1 2152/4885CA2 3385/4885
US-20080234314-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P CA12 4717/4885CA1 3664/4885CA2 4250/4885

“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.

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