SCHEMBL4700495

SCHEMBL4700495

O=[N+]([O-])c1cc(I)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 3/20 0.62
MAPK1 P28482 2/20 0.62
TP53 P04637 2/20 0.62
HPGD P15428 2/20 0.62
TSHR P16473 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
ALDH1A1 P00352 1/20 0.62
L3MBTL1 Q9Y468 2/20 0.60
ALOX15 P16050 1/20 0.60
HSD17B10 Q99714 1/20 0.60
ALDH5A1 P51649 1/20 0.56
ABAT P80404 1/20 0.56
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA9 Q16790 1/20 0.56
MAPT P10636 4/20 0.55
KDM4E B2RXH2 2/20 0.55
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55

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
Acetic Acid SCHEMBL27581272 0.91 GPR35 (0.53) GPR35MAPK1TP53HPGDTSHR
SCHEMBL648045 0.83 GPR35 (0.62) GPR35MAPK1TP53HPGDTSHR
SCHEMBL19113276 0.81 ERN1 (0.45) GPR35MAPK1TP53HPGDTSHR
SCHEMBL6840900 0.80 TSHR (0.56) GPR35MAPK1TP53HPGDTSHR
SCHEMBL1665978 0.78 PARP1 (0.56) GPR35MAPK1TP53HPGDTSHR
SCHEMBL14371934 0.78 MAPT (0.43) GPR35MAPK1TP53TSHRALDH1A1
SCHEMBL4368126 0.78 MAPT (0.67) GPR35MAPK1TP53HPGDTSHR
SCHEMBL69947 0.78 MAPK1 (0.67) GPR35MAPK1TP53HPGDTSHR
SCHEMBL6031674 0.78 MAPK1 (0.67) GPR35MAPK1TP53HPGDTSHR
SCHEMBL29502912 0.78 MAPK1 (0.67) GPR35MAPK1TP53HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114113370-B Analysis method of aromatic halogenated disinfection byproducts in water 东南大学 2024-03-26 CN claimed
CN-114113370-A Analysis method of aromatic halogenated disinfection byproducts in water 东南大学 2022-03-01 CN claimed
EP-0460111-B1 PREPARATION OF 4-SUBSTITUTED ARYL OLEFINS EASTMAN KODAK CO (US) 1993-12-08 EP claimed
EP-0460111-A1 PREPARATION OF 4-SUBSTITUTED ARYL OLEFINS. EASTMAN KODAK CO (US) 1991-12-11 EP claimed
US-4965361-A CATALYTIC REACTION OF 4-SUBSTITUTED ARYL IODIDE WITH OLEFIN IN ESTER SOLVENT EASTMAN KODAK COMPANY (US) 1990-10-23 US claimed
EP-0388322-A1 Preparation of 4-substituted aryl olefins EASTMAN KODAK COMPANY (US) 1990-09-19 EP claimed
WO-1990009973-A1 PREPARATION OF 4-SUBSTITUTED ARYL OLEFINS EASTMAN KODAK COMPANY (US) 1990-09-07 WO claimed
US-20250171427-A1 THERAPEUTIC COMPOUNDS SANOFI (FR) 2025-05-29 US disclosed
WO-2025104230-A1 BENZOXAZOLES AS MODULATORS OF IL-17A SANOFI (FR) 2025-05-22 WO disclosed
US-20250154107-A1 3,4-Dihydroisoquinolin-1(2H)-Ones Derivatives as STING Antagonists and the Use Thereof BEIGENE SWITZERLAND GMBH (CH) 2025-05-15 US disclosed
EP-4448513-A1 3, 4-DIHYDROISOQUINOLIN-1 (2H) -ONES DERIVATIVES AS STING ANTAGONISTS AND THE USE THEREOF BeiGene Switzerland GmbH (CH) 2024-10-23 EP disclosed
US-20240254138-A1 TRICYCLIC PYRIMIDINES AS CYCLIN-DEPENDENT KINASE 7 (CDK7) INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2024-08-01 US disclosed
CN-118401514-A 3, 4-Dihydroisoquinolin-1 (2H) -one derivatives as STING antagonists and uses thereof 百济神州有限公司 2024-07-26 CN disclosed
EP-0522469-A2 Preparation of poly(benz(ox, imid, thi)azole) polymers EASTMAN KODAK COMPANY (US) 1993-01-13 EP disclosed
US-5149755-A Aroatmic amine and halide reactants EASTMAN KODAK COMPANY (US) 1992-09-22 US disclosed
EP-0460111-A1 PREPARATION OF 4-SUBSTITUTED ARYL OLEFINS. EASTMAN KODAK CO (US) 1991-12-11 EP disclosed
US-4965361-A CATALYTIC REACTION OF 4-SUBSTITUTED ARYL IODIDE WITH OLEFIN IN ESTER SOLVENT EASTMAN KODAK COMPANY (US) 1990-10-23 US disclosed
EP-0388322-A1 Preparation of 4-substituted aryl olefins EASTMAN KODAK COMPANY (US) 1990-09-19 EP disclosed
WO-1990009973-A1 PREPARATION OF 4-SUBSTITUTED ARYL OLEFINS EASTMAN KODAK COMPANY (US) 1990-09-07 WO disclosed
US-4940657-A Photographic spectral sensitizing dye MITSUBISHI PAPER MILLS LIMITED (JP) 1990-07-10 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 (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-20240254138-A1 TRICYCLIC PYRIMIDINES AS CYCLIN-DEPENDENT KINASE 7 (CDK7) INHIBITORS CDK7, CDK2, CCNK GPR35 2264/4885MAPK1 364/4885TP53 287/4885
US-20250171427-A1 THERAPEUTIC COMPOUNDS IL17A, IL2, IL36G GPR35 620/4885MAPK1 1728/4885TP53 779/4885
US-20250154107-A1 3,4-Dihydroisoquinolin-1(2H)-Ones Derivatives as STING Antagonists and the Use Thereof STING1, IRF3, MAVS GPR35 827/4885MAPK1 3340/4885TP53 1003/4885

“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.