SCHEMBL8962250

SCHEMBL8962250

Cc1cccc(S(=O)(=O)c2cccc(C(=O)O)c2C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
FEN1 P39748 1/20 0.44
MCL1 Q07820 1/20 0.43
METAP2 P50579 2/20 0.43
ABCC9 O60706 1/20 0.41
ABCC8 Q09428 1/20 0.41
KCNJ11 Q14654 1/20 0.41
KCNJ8 Q15842 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
KAT6A Q92794 2/20 0.41
MAPT P10636 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALOX15 P16050 1/20 0.41
FABP4 P15090 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL19040679 0.85 AKR1C3 (0.46) POLBFEN1ALDH1A1KMT2AMEN1
SCHEMBL29676384 0.84 NPSR1 (0.47) POLBALDH1A1KMT2AMAPTSMN1; SMN2
SCHEMBL34677 0.84 NPSR1 (0.47) POLBALDH1A1KMT2AMAPTSMN1; SMN2
SCHEMBL1482049 0.82 POLB (0.48) POLBALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL29435078 0.81 ALOX15 (0.48) POLBALDH1A1MAPTSMN1; SMN2ALOX15
SCHEMBL347237 0.81 ALOX15 (0.48) POLBALDH1A1MAPTSMN1; SMN2ALOX15
SCHEMBL11610684 0.78 MMP2 (0.55) SMN1; SMN2ALOX15
SCHEMBL11608183 0.77 SLC16A1 (0.44) POLBALDH1A1KMT2AMEN1MAPT
SCHEMBL11607950 0.77 ALOX15 (0.44) ALOX15
SCHEMBL11583249 0.76 POLB (0.44) POLBALDH1A1KMT2AMEN1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5530130-A DYEING PLASTICS BAYER AKTIENGESELLSCHAFT (DE) 1996-06-25 US disclosed
EP-0639624-A1 Phthaloperinone dyestuffs BAYER AG (DE) 1995-02-22 EP disclosed