Propylamine

Propylamine

SCHEMBL8911200

CCCN.COC(=O)CCc1ccc(N2CCN(c3ccc(C)cc3)C2=O)cc1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.44
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
HTT P42858 2/20 0.39
HDAC1 Q13547 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7283243 0.89 HRH3 (0.44) S1PR1HRH3HDAC1MAPTCYP4F2
Propylamine SCHEMBL8911584 0.87 S1PR1 (0.55) S1PR1MEN1RAB9AKMT2AHTT
SCHEMBL7281838 0.87 HRH3 (0.44) S1PR1HRH3HDAC1MAPTCYP4F2
Hydrochloric Acid SCHEMBL7282229 0.85 HRH3 (0.43) S1PR1HRH3HDAC1MAPTCYP4F2
SCHEMBL27397736 0.83 MEN1 (0.51) S1PR1MEN1RAB9AKMT2AHRH3
SCHEMBL7272483 0.81 S1PR1 (0.44) S1PR1MEN1KMT2AHRH3HTT
Hydrochloric Acid SCHEMBL7272819 0.81 HRH3 (0.44) S1PR1HRH3HDAC1MAPT
SCHEMBL7280993 0.81 HDAC1 (0.46) S1PR1KMT2AHRH3HDAC1L3MBTL1
SCHEMBL7283131 0.81 HRH3 (0.43) S1PR1HRH3HDAC1L3MBTL1MAPT
SCHEMBL7272906 0.81 F10 (0.42) S1PR1HRH3HDAC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650424-A ANTIAGGLOMERANTS USING IMIDAZOLIDINDIONES DR. KARL THOMAE GMBH (DE) 1997-07-22 US disclosed
US-5478942-A Antiinflammatory agents, antiagglomerants KARL THOMAE GMBH (DE) 1995-12-26 US disclosed
US-5276049-A Treatment of thrombosis DR. KARL THOMAE GMBH (DE) 1994-01-04 US disclosed