SCHEMBL1108964

SCHEMBL1108964

Cc1nc2cc(S(=O)(=O)c3ccccc3)ccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMS P04818 3/20 0.48
ALDH1A1 P00352 3/20 0.46
POLB P06746 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 2/20 0.43
HPGD P15428 1/20 0.43
HTR6 P50406 2/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PARP1 P09874 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 1/20 0.41
HSP90AA1 P07900 1/20 0.41
ESR2 Q92731 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
FEN1 P39748 1/20 0.41
HTR2C P28335 1/20 0.40

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
SCHEMBL30166994 0.82 HTR6 (0.42) TYMSALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL8501874 0.81 NPBWR1 (0.47) ALDH1A1HPGDMEN1KMT2AHSP90AA1
SCHEMBL10896181 0.80 NPC1 (0.48) ALDH1A1POLBSMN1; SMN2MAPTRAB9A
SCHEMBL14493326 0.80 MAPT (0.51) ALDH1A1MAPTHPGDHSD17B10MEN1
SCHEMBL4318643 0.80 HDAC6 (0.46) TYMSALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL12213875 0.79 NPBWR1 (0.54) ALDH1A1POLBSMN1; SMN2MAPTRAB9A
Hydrochloric Acid SCHEMBL32662723 0.78 ALDH1A1 (0.44) TYMSALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL11371864 0.77 TAS2R14 (0.54) ALDH1A1SMN1; SMN2HTR6MEN1KMT2A
SCHEMBL10627091 0.76 LMNA (0.56) ALDH1A1POLBSMN1; SMN2HPGDMAPK1
SCHEMBL15381368 0.76 POLB (0.54) ALDH1A1POLBSMN1; SMN2MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153385-B2 Target protein and target gene in drug designing and screening method REVERSE PROTEOMICS RESEARCH INSTITUTE CO., LTD. (JP) 2012-04-10 US disclosed
US-8153385-B2 Target protein and target gene in drug designing and screening method REVERSE PROTEOMICS RESEARCH INSTITUTE CO., LTD. (JP) 2012-04-10 US disclosed
US-20100136524-A1 TARGET PROTEIN AND TARGET GENE IN DRUG DESIGNING AND SCREENING METHOD REVERSE PROTEOMICS RESEARCH INSTITUTE CO., LTD. (JP) 2010-06-03 US disclosed
US-20100136524-A1 TARGET PROTEIN AND TARGET GENE IN DRUG DESIGNING AND SCREENING METHOD REVERSE PROTEOMICS RESEARCH INSTITUTE CO., LTD. (JP) 2010-06-03 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-20100136524-A1 TARGET PROTEIN AND TARGET GENE IN DRUG DESIGNING AND SCREENING METHOD CHP1, CMA1, CARHSP1 TYMS 3716/4885ALDH1A1 3307/4885POLB 4610/4885

“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.