SCHEMBL6979087

SCHEMBL6979087

O=S(=O)(Nc1cccc2cccnc12)c1ccc2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 7/20 1.00
▸ GLO1 Q04760 7/20 1.00
▸ KMT2A Q03164 7/20 1.00
▸ MEN1 O00255 6/20 1.00
▸ SLC40A1 Q9NP59 9/20 0.74
▸ AGTR1 P30556 3/20 0.74
▸ G6PD P11413 1/20 0.74
▸ NFKBIA P25963 1/20 0.74
▸ METAP2 P50579 1/20 0.74
▸ METAP1 P53582 1/20 0.74
▸ PAX8 Q06710 1/20 0.74
▸ ATM Q13315 1/20 0.74
▸ PLAU P00749 1/20 0.70
▸ POLB P06746 1/20 0.70
▸ MITF O75030 1/20 0.69
▸ S1PR4 O95977 1/20 0.69
▸ ALDH1A1 P00352 1/20 0.69
▸ LMNA P02545 1/20 0.69
▸ MAPT P10636 1/20 0.69
▸ S1PR1 P21453 1/20 0.69

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
SCHEMBL8583772 0.91 TDP1 (0.82) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL442367 0.85 SLC40A1 (1.00) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL416258 0.84 MEN1 (0.73) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL7746129 0.84 SLC40A1 (0.97) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL13485937 0.84 SLC40A1 (0.74) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL16750883 0.84 SLC40A1 (0.74) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL30925435 0.84 SLC40A1 (0.74) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL13485924 0.83 GLO1 (0.84) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL11973786 0.83 SLC40A1 (1.00) TDP1GLO1KMT2AMEN1SLC40A1
SCHEMBL22076984 0.82 MEN1 (1.00) TDP1GLO1KMT2AMEN1SLC40A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240148744-A1 SULFONAMIDES AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES ZOETIS LLC 2024-05-09 — — US disclosed
US-20240019450-A1 FLUORESCENT SENSORS THE UNIVERSITY OF SYDNEY (AU) 2024-01-18 — — US disclosed
US-20240019450-A1 FLUORESCENT SENSORS THE UNIVERSITY OF SYDNEY (AU) 2024-01-18 — — US disclosed
US-20100041653-A1 COMPOSITION AND METHODS FOR THE DESIGN AND DEVELOPMENT OF METALLO-ENZYME INHIBITORS BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-02-18 — — US disclosed
US-20100041653-A1 COMPOSITION AND METHODS FOR THE DESIGN AND DEVELOPMENT OF METALLO-ENZYME INHIBITORS BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-02-18 — — US disclosed
EP-0991624-B1 PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT BOEHRINGER INGELHEIM PHARMA (DE) 2003-11-19 — — EP disclosed
US-6528187-B1 Luminescence element comprising pair of electrodes having formed therebetween plurality of organic compound thin film layers comprising electron-transporting layer which comprises specified compound FUJI PHOTO FILM CO., LTD. (JP) 2003-03-04 — — US disclosed
EP-0991624-A1 PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT Boehringer Ingelheim Pharma KG (DE) 2000-04-12 — — EP disclosed
WO-1999000371-A1 PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT BOEHRINGER INGELHEIM PHARMA KG (DE) 1999-01-07 — — WO 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-20240148744-A1 SULFONAMIDES AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES ARSA, MRPS2, SULT2A1 TDP1 4247/4885GLO1 3779/4885KMT2A 1323/4885
US-20100041653-A1 COMPOSITION AND METHODS FOR THE DESIGN AND DEVELOPMENT OF METALLO-ENZYME INHIBITORS HELZ, MMEL1, GAA TDP1 1854/4885GLO1 2965/4885KMT2A 764/4885
US-20240019450-A1 FLUORESCENT SENSORS NCS1, TRPA1, AQP1 TDP1 1733/4885GLO1 61/4885KMT2A 4144/4885

“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.

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