SCHEMBL229536

SCHEMBL229536

CN(C)c1ccccc1-c1ccccc1P(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
NSD2 O96028 1/20 0.41
EGFR P00533 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP3A4 P08684 1/20 0.39
DRD1 P21728 2/20 0.37
GAA P10253 2/20 0.33
HTR6 P50406 2/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
PTK2B Q14289 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL29444117 1.00 ALDH1A1 (0.41) ALDH1A1MAPTTDP1L3MBTL1NSD2
SCHEMBL29822698 1.00 ALDH1A1 (0.41) ALDH1A1MAPTTDP1L3MBTL1NSD2
Bromide SCHEMBL1033291 0.96 ALDH1A1 (0.39) ALDH1A1MAPTTDP1L3MBTL1NSD2
SCHEMBL1033292 0.93 ALDH1A1 (0.37) ALDH1A1MAPTTDP1L3MBTL1NSD2
SCHEMBL2523285 0.89 TDP1 (0.34) ALDH1A1MAPTTDP1L3MBTL1NSD2
SCHEMBL29513054 0.86 MAPT (0.50) ALDH1A1MAPTTDP1L3MBTL1NSD2
SCHEMBL17606910 0.86 MAPT (0.50) ALDH1A1MAPTTDP1L3MBTL1NSD2
SCHEMBL1768181 0.84 MAPT (0.49) ALDH1A1MAPTTDP1L3MBTL1NSD2
SCHEMBL1622430 0.84 TDP1 (0.46) ALDH1A1MAPTTDP1L3MBTL1NSD2
Bromide SCHEMBL7609603 0.82 TDP1 (0.44) ALDH1A1MAPTTDP1L3MBTL1NSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427468-B2 PREPARATION OF A METAL COMPLEX JOHNSON MATTHEY PLC (GB) 2025-06-04 EP claimed
EP-4267591-A2 ORGANOMETALLIC COMPOUNDS Umicore AG & Co. KG (DE) 2023-11-01 EP claimed
WO-2022136049-A2 ORGANOMETALLIC COMPOUNDS UMICORE AG & CO. KG (DE) 2022-06-30 WO claimed
WO-2022103990-A1 METHODS OF MODIFYING PHOSPHORYLATED OR SULFATED TYROSINE RESIDUES OF POLYPEPTIDES PHOSFISH LLC (US) 2022-05-19 WO claimed
US-20220144883-A1 METHODS OF MODIFYING PHOSPHORYLATED OR SULFATED TYROSINE RESIDUES OF POLYPEPTIDES PHOSFISH LLC 2022-05-12 US claimed
EP-2427468-B1 PREPARATION OF A METAL COMPLEX JOHNSON MATTHEY PLC (GB) 2017-06-14 EP claimed
US-7531695-B2 Therapeutic agents for the treatment of cancer, metabolic diseases and skin disorders AUSPEX PHARMACEUTICAL, INC (US) 2009-05-12 US claimed
WO-2009051417-A2 PHENANTHRENE LACTAM DERIVATIVES HAVING ANTICANCER ACTIVITY AND METHOD FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2009-04-23 WO claimed
US-20070129392-A1 Novel therapeutic agents for the treatment of cancer, metabolic diseases and skin disorders AUSPEX PHARMACEUTICALS, INC. 2007-06-07 US claimed
US-20070078189-A1 Novel therapeutic agents for the treatment of cancer, metabolic diseases and skin disorders AUSPEX PHARMACEUTICALS (US) 2007-04-05 US claimed
EP-1636160-A4 NOVEL THERAPEAUTIC AGENTS FOR THE TREATMENT OF CANCER, METABOLIC DISEASES AND SKIN DISORDERS AUSPEX PHARMACEUTICALS (US) 2006-09-27 EP claimed
EP-1636160-A2 NOVEL THERAPEAUTIC AGENTS FOR THE TREATMENT OF CANCER, METABOLIC DISEASES AND SKIN DISORDERS Auspex Pharmaceuticals (US) 2006-03-22 EP claimed
WO-2005123682-A1 METHOD FOR THE PRODUCTION OF 5-ARYL NICOTINALDEHYDES MERCK PATENT GMBH (DE) 2005-12-29 WO claimed
WO-2005108338-A1 NOVEL THERAPEUTIC AGENTS FOR THE TREATMENT OF CANCER, METABOLIC DISEASES AND SKIN DISORDERS AUSPEX PHARMACEUTICALS (US) 2005-11-17 WO claimed
WO-2005000233-A2 NOVEL THERAPEAUTIC AGENTS FOR THE TREATMENT OF CANCER, METABOLIC DISEASES AND SKIN DISORDERS AUSPEX PHARMACEUTICALS (US) 2005-01-06 WO claimed
US-12606550-B2 Methods for synthesis of CHK1 inhibitors CRT PIONEER FUND LP (GB) 2026-04-21 US disclosed
EP-3927685-B1 A PROCESS FOR THE SYNTHESIS ANTHRANILIC DIAMIDE COMPOUNDS AND INTERMEDIATES THEREOF PI INDUSTRIES LTD (IN) 2025-10-08 EP disclosed
US-20020016509-A1 Transition metal-catalyzed process for addition of amines to carbon-carbon double bonds YALE UNIVERSITY 2002-02-07 US disclosed
US-6057456-A CATALYTIC REACTION USING BASE AND METAL CATALYST FOR REACTION YALE UNIVERSITY (US) 2000-05-02 US disclosed
US-5977361-A Transition metal-catalyzed process for preparing N-aryl compounds YALE UNIVERSITY (US) 1999-11-02 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-20220144883-A1 METHODS OF MODIFYING PHOSPHORYLATED OR SULFATED TYROSINE RESIDUES OF POLYPEPTIDES PTMS, ACP1, SRMS ALDH1A1 4739/4885MAPT 2781/4885TDP1 1062/4885
US-12606550-B2 Methods for synthesis of CHK1 inhibitors CHEK1, CHEK2, RAD1 ALDH1A1 3198/4885MAPT 816/4885TDP1 131/4885
US-20070078189-A1 Novel therapeutic agents for the treatment of cancer, metabolic diseases and skin disorders GPR119, IGF1R, CCNE2 ALDH1A1 463/4885MAPT 4729/4885TDP1 3610/4885
US-20020016509-A1 Transition metal-catalyzed process for addition of amines to carbon-carbon double bonds COASY, CMA1, ATIC ALDH1A1 193/4885MAPT 1475/4885TDP1 3430/4885
US-20070129392-A1 Novel therapeutic agents for the treatment of cancer, metabolic diseases and skin disorders IGF1R, INSR, BRCA1 ALDH1A1 826/4885MAPT 4558/4885TDP1 3636/4885

“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.