Propylamine

Propylamine

SCHEMBL8942567

CC(=O)Nc1ccc(OC2CCCCC2)c(NS(C)(=O)=O)c1.CCCN

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.48
PTGS2 P35354 2/20 0.46
CYP19A1 P11511 2/20 0.45
MEN1 O00255 1/20 0.45
PTGES O14684 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPT P10636 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
PTGS1 P23219 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
P2RX4 Q99571 1/20 0.43
POLB P06746 1/20 0.43
PDE4B Q07343 1/20 0.42
PDE4D Q08499 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
SCHEMBL8979006 0.84 ALDH1A1 (0.53) RORCPTGS2CYP19A1MEN1PTGES
SCHEMBL8942563 0.83 RORC (0.47) RORCPTGS2CYP19A1MEN1PTGES
SCHEMBL8942579 0.80 MEN1 (0.47) RORCPTGS2CYP19A1MEN1PTGES
SCHEMBL8979019 0.79 PTGS2 (0.49) RORCPTGS2CYP19A1MEN1PTGES
SCHEMBL9235400 0.76 PTGS2 (0.46) RORCPTGS2CYP19A1MEN1PTGES
SCHEMBL8979023 0.75 PTGS2 (0.57) PTGS2CYP19A1MEN1PTGESALDH1A1
SCHEMBL9233770 0.70 PTGS2 (0.42) RORCPTGS2CYP19A1MEN1PTGES
SCHEMBL9233767 0.70 PTGS2 (0.47) PTGS2CYP19A1MEN1PTGESALDH1A1
SCHEMBL8523784 0.70 PTGS1 (0.61) PTGS2CYP19A1MEN1PTGESALDH1A1
SCHEMBL8942521 0.69 CYP19A1 (0.82) PTGS2CYP19A1MEN1PTGESALDH1A1

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
US-5521311-A USEFUL AS ANTIINFLAMMATORY AGENTS, ANTIPYRETICS, ANALGESICS AND ANTI-ALLERGENIC AGENTS TAISHO PHARMACEUTICAL CO., LTD. (JP) 1996-05-28 US disclosed