Isopropylamine

Isopropylamine

SCHEMBL9812410

CC(C)N.CCCCCCCCCCCCc1ccccc1CS(=O)(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 1/20 0.50
S1PR1 P21453 1/20 0.50
S1PR3 Q99500 1/20 0.50
LIPG Q9Y5X9 1/20 0.47
BID P55957 3/20 0.44
MCL1 Q07820 3/20 0.44
PPARA Q07869 3/20 0.44
BCL2L1 Q07817 2/20 0.44
BAK1 Q16611 2/20 0.44
KAT8 Q9H7Z6 2/20 0.44
PPARG P37231 2/20 0.44
EP300 Q09472 1/20 0.44
KAT2A Q92830 1/20 0.44
KAT2B Q92831 1/20 0.44
KAT5 Q92993 1/20 0.44
SAE1 Q9UBE0 1/20 0.44
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
CYSLTR2 Q9NS75 6/20 0.43
CYSLTR1 Q9Y271 6/20 0.43

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
SCHEMBL7787198 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL7784174 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL27590809 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL7785988 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL7783832 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL7784228 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL7569431 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL57426 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL7786055 0.92 LIPG (0.54) S1PR2S1PR1S1PR3LIPGBID
SCHEMBL4004090 0.91 LIPG (0.53) S1PR2S1PR1S1PR3LIPGBID

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
EP-0229899-B1 PAINTS DESOWAG Materialschutz GmbH (DE) 1991-07-03 EP claimed