SCHEMBL9178596

SCHEMBL9178596

O=C1CC(=O)N(C(OCc2ccccc2)c2ccccc2)C(=O)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
MAPT P10636 4/20 0.38
LMNA P02545 1/20 0.38
SLC1A3 P43003 2/20 0.36
SLC1A2 P43004 2/20 0.36
SLC1A1 P43005 2/20 0.36
DDB1 Q16531 2/20 0.36
CRBN Q96SW2 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
HTT P42858 1/20 0.35
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL11651632 0.77 SLC6A4 (0.47) MEN1KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL16321190 0.76 KMT2A (0.41) MEN1KMT2AMAPTLMNACYP2C19
SCHEMBL16321189 0.76 KMT2A (0.41) MEN1KMT2AMAPTLMNACYP2C19
SCHEMBL11650115 0.76 MEN1 (0.42) MEN1KMT2AMAPTLMNADDB1
SCHEMBL9419046 0.73 MAPT (0.49) MEN1KMT2AMAPTLMNACYP2D6
SCHEMBL11652243 0.72 MEN1 (0.42) MEN1KMT2AMAPTLMNADDB1
SCHEMBL11653597 0.72 MEN1 (0.56) MEN1KMT2AMAPTLMNAOPRL1
SCHEMBL5014355 0.72 MEN1 (0.51) MEN1KMT2AMAPTLMNADDB1
SCHEMBL8161476 0.70 MEN1 (0.37) MEN1KMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL11654111 0.70 MAPT (0.39) MEN1KMT2ASLC6A2SLC6A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3836940-A1 METHODS AND COMPOSITIONS FOR REDUCING FLUOROURACIL INDUCED TOXICITY Tosk, Inc. (US) 2021-06-23 EP disclosed
WO-2020036975-A1 METHODS AND COMPOSITIONS FOR REDUCING FLUOROURACIL INDUCED TOXICITY TOSK, INC. (US) 2020-02-20 WO disclosed
EP-0526537-B1 5-BENZYL BARBITURATE DERIVATIVES UNIV BROWN RES FOUND (US) 1995-07-12 EP disclosed
EP-0526537-A1 5-BENZYL BARBITURATE DERIVATIVES. UNIV BROWN RES FOUND (US) 1993-02-10 EP disclosed
US-5141943-A Water soluble uridine phosphorylase inhibitors, reducing toxicity and anemia of antiviral drugs BROWN UNIVERSITY RESEARCH FOUNDATION (US) 1992-08-25 US disclosed
WO-1991016315-A1 5-BENZYL BARBITURATE DERIVATIVES BROWN UNIVERSITY RESEARCH FOUNDATION (US) 1991-10-31 WO disclosed