SCHEMBL8973198

SCHEMBL8973198

O=C1CN(S(=O)(=O)c2ccc3c([N+](=O)[O-])cccc3c2)C(=O)N1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
KMT2A Q03164 5/20 0.40
MEN1 O00255 3/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 4/20 0.39
POLB P06746 3/20 0.39
ATM Q13315 1/20 0.39
MAPT P10636 3/20 0.37
VCAM1 P19320 1/20 0.37
NPBWR1 P48145 1/20 0.36
MCHR1 Q99705 1/20 0.36
TSHR P16473 1/20 0.36
LMNA P02545 2/20 0.36
SHMT2 P34897 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MITF O75030 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CRHBP P24387 1/20 0.36

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
SCHEMBL8972886 0.90 ALDH1A1 (0.40) ALDH1A1KMT2AMEN1HSD17B10TDP1
SCHEMBL10680095 0.81 HSD17B10 (0.42) ALDH1A1KMT2AMEN1HSD17B10TDP1
SCHEMBL8973561 0.81 HTR6 (0.47) ALDH1A1KMT2AMEN1HSD17B10TDP1
SCHEMBL9804602 0.79 KMT2A (0.41) ALDH1A1KMT2AMEN1TDP1POLB
SCHEMBL8973411 0.78 PKM (0.52) ALDH1A1KMT2AMEN1HSD17B10POLB
SCHEMBL8973603 0.74 TDP1 (0.45) ALDH1A1KMT2AMEN1HSD17B10TDP1
SCHEMBL8973579 0.72 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1TDP1MAPT
SCHEMBL28472152 0.72 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1TDP1POLB
SCHEMBL9734100 0.72 ALDH1A1 (0.56) ALDH1A1HSD17B10TDP1TSHRSMN1; SMN2
SCHEMBL14058836 0.72 CA2 (0.58) ALDH1A1TDP1POLBMAPTVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE35279-E ALDOSE REDUCTASE INHIBITORS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1996-06-18 US disclosed
US-5202339-A Hypoglycemic, hypolipedemic agents MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0305947-B1 HYDANTOIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AS WELL AS THEIR USE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1992-07-29 EP disclosed
US-5004751-A Antidiabetic agents; aldoe reductase inhibitors MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1991-04-02 US disclosed
US-4914099-A TREATMENT OR PREVENTION OF DIABETIC COMPLICATIONS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1990-04-03 US disclosed
WO-1989001934-A1 HYDANTOIN DERIVATIVES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1989-03-09 WO disclosed
EP-0305947-A1 Hydantoin derivatives, process for their preparation and pharmaceutical compositions containing the same as well as their use MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1989-03-08 EP disclosed