SCHEMBL378877

SCHEMBL378877

CC(C)(C)[Si](C)(C)Oc1cccc(CBr)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.42
CA1 P00915 4/20 0.42
CA9 Q16790 4/20 0.42
IDO1 P14902 2/20 0.39
AGXT P21549 2/20 0.39
TAAR1 Q96RJ0 3/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
PREP P48147 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
BCHE P06276 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
TRPA1 O75762 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
LPO P22079 1/20 0.34
CALM1 P0DP23 1/20 0.34
CAMKK2 Q96RR4 1/20 0.34

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
SCHEMBL29975825 1.00 CA12 (0.42) CA12CA1CA9IDO1AGXT
SCHEMBL19745618 0.87 CA12 (0.40) CA12CA1CA9IDO1AGXT
SCHEMBL14382682 0.86 CA12 (0.42) CA12CA1CA9IDO1AGXT
SCHEMBL559965 0.85 KDR (0.41) CA12CA1CA9IDO1AGXT
SCHEMBL3866939 0.85 MAOB (0.43) CA12CA1CA9IDO1AGXT
SCHEMBL558917 0.85 CA12 (0.41) CA12CA1CA9IDO1AGXT
SCHEMBL4327915 0.85 CA12 (0.44) CA12CA1CA9IDO1AGXT
SCHEMBL29851528 0.85 KDR (0.41) CA12CA1CA9IDO1AGXT
SCHEMBL2217582 0.84 TAAR1 (0.41) IDO1AGXTTAAR1CNR1CNR2
SCHEMBL7706827 0.83 CA1 (0.50) CA12CA1CA9HSP90AA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4626548-A1 NON PEPTIDERGIC AGONISTS OF OXYTOCIN RECEPTOR Université de Strasbourg (FR) 2025-10-08 EP disclosed
US-12213973-B2 Bacterial nitric oxide synthase inhibitors NORTHWESTERN UNIVERSITY (US) 2025-02-04 US disclosed
WO-2024115667-A1 NON PEPTIDERGIC AGONISTS OF OXYTOCIN RECEPTOR UNIVERSITE DE STRASBOURG (FR) 2024-06-06 WO disclosed
US-20240018131-A1 MATRIX METALLOPROTEINASE (MMP) INHIBITORS AND METHODS OF USE THEREOF FORESEE PHARMACEUTICALS USA, INC. 2024-01-18 US disclosed
US-11739080-B2 Matrix metalloproteinase (MMP) inhibitors and methods of use thereof FORESEE PHARMACEUTICALS USA, INC. (US) 2023-08-29 US disclosed
US-11725000-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-08-15 US disclosed
US-20230210840-A1 BACTERIAL NITRIC OXIDE SYNTHASE INHIBITORS NORTHWESTERN UNIVERSITY 2023-07-06 US disclosed
US-20230210840-A1 BACTERIAL NITRIC OXIDE SYNTHASE INHIBITORS NORTHWESTERN UNIVERSITY 2023-07-06 US disclosed
US-20210309647-A1 Apoptosis Inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-10-07 US disclosed
US-11034680-B2 Apoptosis inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2021-06-15 US disclosed
EP-0462830-B1 Cyclic ether derivatives ZENECA LTD (GB) 1995-10-18 EP disclosed
US-5407945-A Pyran derivatives and their use as inhibitors of 5-lipoxygenase IMPERIAL CHEMICAL INDUSTRIES, INC. (GB) 1995-04-18 US disclosed
US-5262540-A FOR INHIBITION OF BLOOD PLATELET AGGREGATION IN MAMMALS BRISTOL-MYERS SQUIBB COMPANY (US) 1993-11-16 US disclosed
US-5254581-A Used in the treatment of various inflammatory and allergic diseases IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-10-19 US disclosed
US-5077305-A Anticoagulants BRISTOL-MYERS SQUIBB CO. (US) 1991-12-31 US disclosed
EP-0462830-A2 Cyclic ether derivatives ZENECA LIMITED (GB) 1991-12-27 EP disclosed
EP-0442448-A2 Heterocyclic carboxylic acids and esters Bristol-Myers Squibb Company (US) 1991-08-21 EP disclosed
EP-0434034-A1 Oxazole derivatives Bristol-Myers Squibb Company (US) 1991-06-26 EP disclosed
US-5011851-A Imidazole carboxylic acids and esters and inhibition of blood platelet aggregation therewith BRISTOL-MYERS SQUIBB CO. (US) 1991-04-30 US disclosed
US-4956379-A Anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 1990-09-11 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 (7 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-11725000-B2 Apoptosis inhibitors BAX, SDHA, SDHB CA12 3096/4885CA1 1080/4885CA9 2210/4885
US-12213973-B2 Bacterial nitric oxide synthase inhibitors NOS1, NOS2, NOS3 CA12 4531/4885CA1 3039/4885CA9 2513/4885
US-20240018131-A1 MATRIX METALLOPROTEINASE (MMP) INHIBITORS AND METHODS OF USE THEREOF MMP12, MMP1, MMP11 CA12 165/4885CA1 1241/4885CA9 424/4885
US-11739080-B2 Matrix metalloproteinase (MMP) inhibitors and methods of use thereof MMP12, MMP1, MMP11 CA12 165/4885CA1 1241/4885CA9 424/4885
US-20230210840-A1 BACTERIAL NITRIC OXIDE SYNTHASE INHIBITORS NOS1, NOS2, NOS3 CA12 4531/4885CA1 3039/4885CA9 2513/4885
US-11034680-B2 Apoptosis inhibitors BAX, SDHA, SDHB CA12 3096/4885CA1 1080/4885CA9 2210/4885
US-20210309647-A1 Apoptosis Inhibitors BAX, SDHA, SDHB CA12 3096/4885CA1 1080/4885CA9 2210/4885

“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.