SCHEMBL692254

SCHEMBL692254

O=C(O)C(Br)c1noc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 11/20 0.45
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
TP53 P04637 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
LMNA P02545 1/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
MAOB P27338 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA13 Q8N1Q1 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
ESR1 P03372 1/20 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
SCHEMBL14185644 1.00 HIF1A (0.45) HIF1ACES2CES1TP53SMN1; SMN2
Isoxazole SCHEMBL4373885 0.88 HIF1A (0.37) HIF1ACES2CES1TP53SMN1; SMN2
SCHEMBL11208465 0.81 HIF1A (0.44) HIF1ATP53SMN1; SMN2
SCHEMBL11202946 0.81 HIF1A (0.46) HIF1ATP53SMN1; SMN2CA12CA1
SCHEMBL5294295 0.80 HIF1A (0.45) HIF1ATP53SMN1; SMN2CA12CA1
SCHEMBL9689288 0.78 FAAH (0.46) HIF1ATP53SMN1; SMN2ALDH1A1
SCHEMBL11211934 0.78 HIF1A (0.43) HIF1ATP53SMN1; SMN2CA12CA1
SCHEMBL753859 0.76 HIF1A (0.42) HIF1ATP53SMN1; SMN2CA12CA1
SCHEMBL4983840 0.76 HIF1A (0.42) HIF1ATP53SMN1; SMN2CA12CA1
SCHEMBL8663680 0.75 ESR1 (0.42) HIF1ASMN1; SMN2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. 2023-03-02 US disclosed
EP-3852790-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X Forma Therapeutics, Inc. (US) 2021-07-28 EP disclosed
CN-113164571-A Inhibition of ubiquitin-specific peptidase 9X 福马治疗股份有限公司 2021-07-23 CN disclosed
WO-2020061261-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. (US) 2020-03-26 WO disclosed
US-20170298080-A1 AMINOSULFONYL COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2017-10-19 US disclosed
US-20170298080-A1 AMINOSULFONYL COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2017-10-19 US disclosed
EP-3192792-A1 AMINOSULFONYL COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF Suzhou Vigonvita Life Sciences Co., Ltd. (CN) 2017-07-19 EP disclosed
EP-2422780-A1 Resistance-repellent retroviral protease inhibitors Sequoia Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
EP-2422781-A1 Resistance-repellent retroviral protease inhibitors Sequoia Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
EP-2422781-A1 Resistance-repellent retroviral protease inhibitors Sequoia Pharmaceuticals, Inc. (US) 2012-02-29 EP disclosed
US-20060258627-A1 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2006-11-16 US disclosed
US-20060135582-A1 Process for the preparation of benzo [d] isoxazol-3-yl-methanesulfonic acid and the intermediates thereof DIPHARMA S.P.A. (IT) 2006-06-22 US disclosed
US-20050267074-A1 Resistance-repellent retroviral protease inhibitors SEQUOIA PHARMACEUTICALS (US) 2005-12-01 US disclosed
WO-2005110428-A2 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2005-11-24 WO disclosed
WO-2005110428-A2 RESISTANCE-REPELLENT RETROVIRAL PROTEASE INHIBITORS SEQUOIA PHARMACEUTICALS, INC. (US) 2005-11-24 WO disclosed
EP-1581508-A1 A PROCESS FOR THE PREPARATION OF BENZO D ISOXAZOL-3-YL- METHANESULFONIC ACID AND THE INTERMEDIATES THEREOF Dipharma S.p.A. (IT) 2005-10-05 EP disclosed
WO-2005044808-A1 A PROCESS FOR THE MANUFACTURE OF ZONISAMIDE WOCKHARDT LIMITED (IN) 2005-05-19 WO disclosed
WO-2004063173-A1 A PROCESS FOR THE PREPARATION OF BENZO[D]ISOXAZOL-3-YL-METHANESULFONIC ACID AND THE INTERMEDIATES THEREOF DIPHARMA S.P.A. (IT) 2004-07-29 WO disclosed
US-4957931-A ANTICONVULSANTS, TREATMENT OF EPILEPSY CIBA-GEIGY CORPORATION (US) 1990-09-18 US disclosed
US-4859691-A Certain 1,2-benzisoxazole derivatives CIBA-GEIGY CORPORATION (US) 1989-08-22 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 (5 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-20230065368-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X USP9X, USP19, USP39 HIF1A 2942/4885CES2 2870/4885CES1 671/4885
US-20050267074-A1 Resistance-repellent retroviral protease inhibitors SERPINB1, MMP7, MME HIF1A 3659/4885CES2 41/4885CES1 162/4885
US-20060258627-A1 Resistance-repellent retroviral protease inhibitors SERPINB1, MMP7, MME HIF1A 3659/4885CES2 41/4885CES1 162/4885
US-20170298080-A1 AMINOSULFONYL COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF NOTUM, ALDH7A1, HADHB HIF1A 4097/4885CES2 607/4885CES1 116/4885
US-20060135582-A1 Process for the preparation of benzo [d] isoxazol-3-yl-methanesulfonic acid and the intermediates thereof GABRD, GABRA5, GABRA6 HIF1A 4044/4885CES2 2469/4885CES1 567/4885

“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.