SCHEMBL7196771

SCHEMBL7196771

Cc1cc(C)c(S(=O)(=O)Nc2cccc3cccnc23)c(C)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 1.00
KMT2A Q03164 5/20 1.00
MEN1 O00255 4/20 1.00
SLC40A1 Q9NP59 12/20 0.69
HTT P42858 2/20 0.67
AGTR1 P30556 2/20 0.67
ALDH1A1 P00352 2/20 0.67
MAPT P10636 2/20 0.67
MITF O75030 1/20 0.67
S1PR4 O95977 1/20 0.67
LMNA P02545 1/20 0.67
S1PR1 P21453 1/20 0.67
OPRK1 P41145 1/20 0.67
CKS1B P61024 1/20 0.67
SKP2 Q13309 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
GLO1 Q04760 5/20 0.61
ALOX15 P16050 2/20 0.61
G6PD P11413 1/20 0.60
NFKBIA P25963 1/20 0.60

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
SCHEMBL11997128 0.90 SLC40A1 (0.82) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL11997124 0.87 SLC40A1 (0.81) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL27214217 0.85 SLC40A1 (0.82) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL30925445 0.85 SLC40A1 (0.82) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL13485953 0.85 TDP1 (0.73) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL30925502 0.84 TDP1 (0.72) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL27214196 0.84 TDP1 (0.72) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL11973308 0.82 SLC40A1 (1.00) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL11973620 0.82 SLC40A1 (0.73) TDP1KMT2AMEN1SLC40A1HTT
SCHEMBL11485539 0.82 SLC40A1 (0.74) TDP1KMT2AMEN1SLC40A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9200046-B2 Reporter system for high throughput screening of compounds and uses thereof CORNELL UNIVERSITY (US) 2015-12-01 US disclosed
US-9200046-B2 Reporter system for high throughput screening of compounds and uses thereof CORNELL UNIVERSITY (US) 2015-12-01 US disclosed
US-20130005666-A1 REPORTER SYSTEM FOR HIGH THROUGHPUT SCREENING OF COMPOUNDS AND USES THEREOF CORNELL UNIVERSITY (US) 2013-01-03 US disclosed
US-20130005666-A1 REPORTER SYSTEM FOR HIGH THROUGHPUT SCREENING OF COMPOUNDS AND USES THEREOF CORNELL UNIVERSITY (US) 2013-01-03 US 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

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-20130005666-A1 REPORTER SYSTEM FOR HIGH THROUGHPUT SCREENING OF COMPOUNDS AND USES THEREOF NFE2, NFE2L2, UBE2N TDP1 3874/4885KMT2A 2699/4885MEN1 3331/4885

“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.