SCHEMBL31190873

SCHEMBL31190873

CC(F)(F)c1ccc(SCc2ccccc2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.41
▸ CYP1A2 P05177 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ PRMT1 Q99873 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ EGFR P00533 2/20 0.37
▸ ALOX15B O15296 1/20 0.37
▸ PTPRC P08575 1/20 0.37
▸ PKM P14618 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ CA12 O43570 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ CA14 Q9ULX7 2/20 0.35
▸ CA3 P07451 1/20 0.35
▸ CA4 P22748 1/20 0.35

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
SCHEMBL31292288 0.77 MMP8 (0.41) POLBCYP1A2L3MBTL1MAPTRAB9A
SCHEMBL31190568 0.76 MAOA (0.50) POLBCYP1A2CYP3A4CYP2D6PRMT1
SCHEMBL29715410 0.74 POLB (0.55) POLBMAPTRAB9ACA12CA1
SCHEMBL23092860 0.74 POLB (0.55) POLBMAPTRAB9ACA12CA1
SCHEMBL15560521 0.74 POLB (0.46) POLBL3MBTL1EGFRPTPRCRAB9A
SCHEMBL22492226 0.74 ALDH1A1 (0.49) POLBCYP1A2CYP3A4CYP2D6L3MBTL1
SCHEMBL28023477 0.73 POLB (0.61) POLBL3MBTL1EGFRPTPRCMAPT
SCHEMBL20063730 0.72 POLB (0.43) POLBCYP1A2CYP3A4CYP2D6PRMT1
SCHEMBL31190735 0.72 KMT2A (0.46) POLBCYP1A2CYP3A4CYP2D6L3MBTL1
SCHEMBL3126876 0.71 MRGPRX4 (0.51) POLBCYP1A2L3MBTL1PTPRCRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024220747-A2 FLUORINATED CYCLIC DERIVATIVES OF SULFONAMIDES AND SULFONES, AND COMPOSITIONS AND METHODS THEREOF Lysoway Therapeutics, Inc. (US) 2024-10-24 — — WO disclosed
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