Sugi Predict

Sugi Predict / Compounds / SCHEMBL2015738

SCHEMBL2015738

SCHEMBL2015738

O=C(NCc1ccccc1)C1CCC(c2cccc(F)c2)N(S(=O)(=O)c2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ PKM P14618 4/20 0.47
▸ TSHR P16473 2/20 0.46
▸ FKBP1A P62942 1/20 0.45
▸ POLB P06746 1/20 0.45

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
SCHEMBL12628947 1.00 ALDH1A1 (0.48) ALDH1A1KMT2AMEN1LMNAPKM
SCHEMBL2015115 0.95 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1LMNAPKM
SCHEMBL12628946 0.95 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1LMNAPKM
SCHEMBL2013288 0.94 PKM (0.49) ALDH1A1KMT2AMEN1LMNAPKM
SCHEMBL12628169 0.94 PKM (0.49) ALDH1A1KMT2AMEN1LMNAPKM
SCHEMBL12628159 0.90 ALDH1A1 (0.54) ALDH1A1KMT2AMEN1PKMFKBP1A
SCHEMBL2011504 0.90 ALDH1A1 (0.54) ALDH1A1KMT2AMEN1PKMFKBP1A
SCHEMBL12628292 0.89 KMT2A (0.55) ALDH1A1KMT2AMEN1PKMTSHR
SCHEMBL2010853 0.89 KMT2A (0.58) ALDH1A1KMT2AMEN1TSHRPOLB
SCHEMBL2012438 0.89 KMT2A (0.53) ALDH1A1KMT2AMEN1PKMTSHR

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-2011073269-A1 PIPERIDINE ARYL SULFONAMIDE DERIVATIVES AS KV1.3 MODULATORS EVOTEC AG (DE) 2011-06-23 — — WO claimed