SCHEMBL8092650

SCHEMBL8092650

CS(=O)(=O)c1ccccc1C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
BCAT2 O15382 1/20 0.57
AKR1C3 P42330 2/20 0.53
MAPT P10636 2/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 4/20 0.48
ELANE P08246 1/20 0.47
CYP1A2 P05177 1/20 0.47
ATM Q13315 2/20 0.46
HSP90AA1 P07900 1/20 0.46
PKM P14618 1/20 0.46
CCR6 P51684 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TLR9 Q9NR96 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 2/20 0.46
CDC25B P30305 1/20 0.43
POLB P06746 1/20 0.42

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
SCHEMBL4321077 0.88 BCAT2 (0.59) KMT2ABCAT2MAPTGAAALDH1A1
SCHEMBL300439 0.82 AKR1C3 (0.55) KMT2AAKR1C3MAPTGAAALDH1A1
SCHEMBL8962200 0.82 CDC25B (0.68) BCAT2AKR1C3ALDH1A1ATMTDP1
SCHEMBL29838630 0.82 BCAT2 (0.62) BCAT2ALDH1A1LMNA
SCHEMBL34748 0.82 BCAT2 (0.62) BCAT2ALDH1A1LMNA
SCHEMBL7022695 0.81 AKR1C3 (0.53) KMT2AAKR1C3MAPTGAAALDH1A1
SCHEMBL29496654 0.81 AKR1C3 (0.53) KMT2AAKR1C3MAPTGAAALDH1A1
SCHEMBL28340031 0.81 AKR1C3 (0.53) KMT2AAKR1C3MAPTGAAALDH1A1
SCHEMBL10854249 0.81 CA2 (0.58) KMT2AAKR1C3MAPTGAAALDH1A1
Water SCHEMBL27666388 0.81 AKR1C3 (0.53) KMT2AAKR1C3MAPTGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1058682-A1 HETEROCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS OF PREPARING THEM AND THEIR USES IN THERAPEUTICS LABORATOIRES UPSA (FR) 2000-12-13 EP disclosed
WO-1999043664-A1 HETEROCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS OF PREPARING THEM AND THEIR USES IN THERAPEUTICS LABORATOIRES UPSA (FR) 1999-09-02 WO disclosed
CN-1215396-A Diarylmethylidene furan derivatives, preparation method and therapeutic use thereof UNION PHARMA SCIENT APPL (FR) 1999-04-28 CN disclosed