SCHEMBL13485919

SCHEMBL13485919

Cc1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1F

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 7/20 0.80
▸ SLC40A1 Q9NP59 11/20 0.70
▸ TDP1 Q9NUW8 7/20 0.69
▸ KMT2A Q03164 6/20 0.69
▸ AGTR1 P30556 2/20 0.69
▸ 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
▸ OPRK1 P41145 1/20 0.69
▸ HTT P42858 1/20 0.69
▸ CKS1B P61024 1/20 0.69
▸ SKP2 Q13309 1/20 0.69
▸ NPSR1 Q6W5P4 1/20 0.69
▸ MEN1 O00255 5/20 0.67
▸ G6PD P11413 1/20 0.62
▸ NFKBIA P25963 1/20 0.62
▸ METAP2 P50579 1/20 0.62

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
SCHEMBL30925435 0.89 SLC40A1 (0.74) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL16750883 0.89 SLC40A1 (0.74) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL13485928 0.83 GLO1 (0.80) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL15508515 0.82 GLO1 (0.76) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL30925492 0.82 GLO1 (0.76) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL11973852 0.82 SLC40A1 (1.00) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL4471796 0.82 TDP1 (1.00) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL6978005 0.82 GLO1 (1.00) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL12598516 0.81 SLC40A1 (0.64) GLO1SLC40A1TDP1KMT2AAGTR1
SCHEMBL30925437 0.81 SLC40A1 (0.74) GLO1SLC40A1TDP1KMT2AAGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20100041653-A1 COMPOSITION AND METHODS FOR THE DESIGN AND DEVELOPMENT OF METALLO-ENZYME INHIBITORS HELZ, MMEL1, GAA GLO1 2965/4885SLC40A1 408/4885TDP1 1854/4885

“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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