SCHEMBL458331

SCHEMBL458331

COc1nc(Cl)ncc1Br

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 2/20 0.39
PIN1 Q13526 3/20 0.39
ULK1 O75385 1/20 0.38
ABL1 P00519 2/20 0.37
BCR P11274 2/20 0.37
CYP1A2 P05177 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CCR4 P51679 6/20 0.34
LRRK2 Q5S007 1/20 0.34
RPS6KA5 O75582 1/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
CCR5 P51681 1/20 0.33

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
SCHEMBL29641805 1.00 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2GAAPIN1
SCHEMBL5258785 0.81 PIN1 (0.45) ALDH1A1SMN1; SMN2PIN1CYP1A2MEN1
SCHEMBL2966721 0.80 CDK1 (0.42) ALDH1A1KDM4ESMN1; SMN2GAAPIN1
SCHEMBL31634163 0.79 GAA (0.36) ALDH1A1KDM4ESMN1; SMN2GAAPIN1
SCHEMBL1981633 0.78 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2GAAPIN1
SCHEMBL16674677 0.78 KDM4E (0.44) ALDH1A1KDM4ESMN1; SMN2GAAPIN1
SCHEMBL1996295 0.77 ALDH1A1 (0.44) ALDH1A1KDM4ESMN1; SMN2GAAPIN1
SCHEMBL2437490 0.77 ALDH1A1 (0.53) ALDH1A1KDM4ESMN1; SMN2GAAPIN1
SCHEMBL13004012 0.77 GAA (0.40) ALDH1A1GAAULK1KMT2ACCR4
SCHEMBL31366250 0.77 GAA (0.40) ALDH1A1GAAULK1KMT2ACCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4744661-A2 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2026-05-20 EP disclosed
US-20260027104-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2026-01-29 US disclosed
EP-4680226-A2 ACYLSULFONAMIDE KAT6A INHIBITORS Olema Pharmaceuticals, Inc. (US) 2026-01-21 EP disclosed
US-20260015327-A1 ACYLSULFONAMIDE KAT6A INHIBITORS OLEMA PHARMACEUTICALS INC (US) 2026-01-15 US disclosed
WO-2025243044-A1 COMPOUNDS Pheno Therapeutics Limited (GB) 2025-11-27 WO disclosed
US-20250361238-A1 1,4-DIPHENYL-1H-INDAZOLE AND 1-PYRIDIN-2-YL-4-PHENYL-1H-INDAZOLE DERIVATIVES AS PD-1/PD-L1 MODULATORS FOR THE TREATMENT OF CANCER SOPONPONG JAKAPUN (TH) 2025-11-27 US disclosed
EP-4298092-B1 NOVEL PYRIMIDIN-2-YL SULFONAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2025-11-26 EP disclosed
US-12466805-B2 Pharmaceutical compounds ALMAC DISCOVERY LIMITED (GB) 2025-11-11 US disclosed
US-20250340528-A1 TARGETED PROTEIN DEGRADATION MONTE ROSA THERAPEUTICS AG (CH) 2025-11-06 US disclosed
US-12459920-B2 Targeted protein degradation MONTE ROSA THERAPEUTICS AG (CH) 2025-11-04 US disclosed
EP-2022785-A1 Alkynylpyrimidines as Tie2 kinase inhibitors Bayer Schering Pharma Aktiengesellschaft (DE) 2009-02-11 EP disclosed
WO-2009001127-A1 CYANOCYCLOPROPYLCARBOXAMIDES AS CATHEPSIN INHIBITORS ASTRAZENECA AB (SE) 2008-12-31 WO disclosed
US-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 US disclosed
WO-2008155140-A1 ALKYNYLPYRIMIDINES AS TIE2 KINASE INHIBITORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-24 WO disclosed
WO-2008155572-A2 FUSED QUINOLINE DERIVATIVES USEFUL AS GABA MODULATORS ASTRAZENECA AB (SE) 2008-12-24 WO disclosed
US-20080064696-A1 SUBSTITUTED SULPHOXIMINES AS TIE2 INHIBITORS AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-03-13 US disclosed
WO-2008006560-A1 SUBSTITUTED SULPHOXIMINES AS TIE2 INHIBITORS AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-01-17 WO disclosed
EP-1856058-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-11-21 EP disclosed
WO-2006094187-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2006-09-08 WO disclosed
US-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2006-09-07 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-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 ALDH1A1 1599/4885KDM4E 929/4885SMN1; SMN2 4540/4885
US-12466805-B2 Pharmaceutical compounds USP19, USP18, UBE2I ALDH1A1 621/4885KDM4E 659/4885SMN1; SMN2 2586/4885
US-12459920-B2 Targeted protein degradation NEK7, NEK1, RIPK1 ALDH1A1 4050/4885KDM4E 3284/4885SMN1; SMN2 787/4885
US-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF ALDH1A1 442/4885KDM4E 2357/4885SMN1; SMN2 764/4885
US-20260027104-A1 NOVEL NAPHTHYL AND ISOQUINOLINE SULFONAMIDE DERIVATIVES CBR3, HAX1, CBR1 ALDH1A1 2920/4885KDM4E 1320/4885SMN1; SMN2 4351/4885
US-20250361238-A1 1,4-DIPHENYL-1H-INDAZOLE AND 1-PYRIDIN-2-YL-4-PHENYL-1H-INDAZOLE DERIVATIVES AS PD-1/PD-L1 MODULATORS FOR THE TREATMENT OF CANCER PDCD1, CD274, PDCD1LG2 ALDH1A1 36/4885KDM4E 805/4885SMN1; SMN2 2854/4885
US-20260015327-A1 ACYLSULFONAMIDE KAT6A INHIBITORS KAT6A, KAT2A, KAT6B ALDH1A1 1068/4885KDM4E 773/4885SMN1; SMN2 3098/4885
US-20250340528-A1 TARGETED PROTEIN DEGRADATION NEK7, NEK1, RIPK1 ALDH1A1 4061/4885KDM4E 3320/4885SMN1; SMN2 782/4885
US-20080064696-A1 SUBSTITUTED SULPHOXIMINES AS TIE2 INHIBITORS AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME TIE1, KDR, TEK ALDH1A1 2471/4885KDM4E 293/4885SMN1; SMN2 1685/4885

“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.