SCHEMBL3909451

SCHEMBL3909451

COc1cc(C=O)ccc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.62
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
ALDH1A1 P00352 13/20 0.61
TSHR P16473 1/20 0.61
HPGD P15428 4/20 0.61
TRIM24 O15164 1/20 0.61
ALDH5A1 P51649 1/20 0.61
ABAT P80404 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
TRIM33 Q9UPN9 1/20 0.61
AOX1 Q06278 1/20 0.56
FDPS P14324 1/20 0.53
TTR P02766 1/20 0.53
KDM4E B2RXH2 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 2/20 0.49
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48

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
SCHEMBL2558253 0.87 ALDH1A1 (0.53) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL29956561 0.86 ALDH1A1 (0.61) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL7033712 0.86 ALDH1A1 (0.61) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL2934800 0.86 ALDH1A1 (0.61) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL10415024 0.84 ALDH1A1 (0.59) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL15652453 0.84 ALDH1A1 (0.65) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL359439 0.84 ALDH1A1 (0.63) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL2558096 0.83 TRIM24 (0.57) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL8128040 0.83 ALDH1A1 (0.56) CYP2C9NPC1RAB9ANPSR1ALDH1A1
SCHEMBL11653267 0.83 CYP2C9 (0.56) CYP2C9NPC1RAB9ANPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4168399-B1 COMPOUNDS AND THEIR USES AS MIF INHIBITORS NANJING IMMUNOPHAGE BIOMEDICAL CO LTD (CN) 2026-04-01 EP disclosed
US-20240083912-A1 COMPOUNDS AND THEIR USES AS MIF INHIBITORS NANJING IMMUNOPHAGE BIOTECH CO LTD (CN) 2024-03-14 US disclosed
US-11884682-B2 Compounds and their uses as MIF inhibitors Nanjing Immunophage Biotech Co., Ltd. (CN) 2024-01-30 US disclosed
CN-116438174-A Compounds and their use as MIF inhibitors 南京艾美斐生物医药科技有限公司 2023-07-14 CN disclosed
EP-4168399-A1 COMPOUNDS AND THEIR USES AS MIF INHIBITORS Nanjing Immunophage Biotech Co., Ltd. (CN) 2023-04-26 EP disclosed
WO-2021258272-A1 COMPOUNDS AND THEIR USES AS MIF INHIBITORS Nanjing Immunophage Biotech Co., Ltd. (CN) 2021-12-30 WO disclosed
US-20210403484-A1 COMPOUNDS AND THEIR USES AS MIF INHIBITORS Nanjing Immunophage Biotech Co., Ltd. (CN) 2021-12-30 US disclosed
EP-3150643-B1 TRIPHENYLMETHANE-BASED COLORED COMPOSITION WAKO PURE CHEM IND LTD (JP) 2017-12-27 EP disclosed
US-20170190818-A1 TRIPHENYLMETHANE-BASED COLORED COMPOSITION WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2017-07-06 US disclosed
US-20170190818-A1 TRIPHENYLMETHANE-BASED COLORED COMPOSITION WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2017-07-06 US disclosed
US-6083961-A FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES SUCH AS ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASE, SHOCK, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-04 US disclosed
US-6015818-A TREATING KIDNEY, BRAIN, AND CARDIOVASCULAR DISORDERS; HYPOTENSIVE AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-01-18 US disclosed
US-5849796-A Ortho-substituted benzoil acid derivatives MERCK PATENT GELSELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-12-15 US disclosed
EP-0879233-A1 CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-11-25 EP disclosed
WO-1997028153-A1 CHINOLINE AND BENZIMIDAZOLE DERIVATIVES AS BRADYKININ AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-07 WO disclosed
EP-0774462-A1 HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed
EP-0704431-A2 Ortho-substituted benzoic acid derivatives MERCK PATENT GmbH (DE) 1996-04-03 EP disclosed
US-4184977-A WHITENING BAYER AKTIENGESELLSCHAFT (DE) 1980-01-22 US disclosed
EP-0000346-B1 QUINOXALINE COMPOUNDS, PROCESS FOR THEIR MANUFACTURE AND THEIR USE AS BRIGHTENERS FOR ORGANIC MATERIALS, AND THE MATERIALS BRIGHTENED THEREWITH BAYER AG (DE) 1980-01-09 EP disclosed
EP-0000346-A1 Quinoxaline compounds, process for their manufacture and their use as brighteners for organic materials, and the materials brightened therewith BAYER AG (DE) 1979-01-24 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 (3 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-11884682-B2 Compounds and their uses as MIF inhibitors MIF, CCL11, CCL2 CYP2C9 2049/4885NPC1 255/4885RAB9A 3018/4885
US-20240083912-A1 COMPOUNDS AND THEIR USES AS MIF INHIBITORS MIF, CCL11, CCL2 CYP2C9 2049/4885NPC1 255/4885RAB9A 3018/4885
US-20210403484-A1 COMPOUNDS AND THEIR USES AS MIF INHIBITORS MIF, CCL11, CCL2 CYP2C9 2049/4885NPC1 255/4885RAB9A 3018/4885

“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.