SCHEMBL5664596

SCHEMBL5664596

CCCCCCCCCN1c2cc(N(C)C)ccc2Cc2ccc(N(C)C)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.39
NPC1 O15118 6/20 0.37
RAB9A P51151 6/20 0.37
HTT P42858 5/20 0.37
LMNA P02545 4/20 0.37
MAPK1 P28482 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
GALR3 O60755 2/20 0.37
POLB P06746 2/20 0.37
ATM Q13315 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
APOBEC3A P31941 2/20 0.37
APOBEC3G Q9HC16 2/20 0.37
HSP90AA1 P07900 1/20 0.37
RAD52 P43351 1/20 0.37
PAX8 Q06710 1/20 0.37

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
SCHEMBL8746787 1.00 MEN1 (0.40) MEN1KMT2AALDH1A1NPC1RAB9A
Hydrochloric Acid SCHEMBL11314459 0.93 KMT2A (0.39) MEN1KMT2AALDH1A1HTTLMNA
SCHEMBL6293211 0.87 SLC6A4 (0.36) MEN1KMT2AALDH1A1NPC1RAB9A
Bromide SCHEMBL6293220 0.86 SLC6A4 (0.35) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL6294511 0.80 HTR1A (0.35) MEN1KMT2ALMNAMAPK1NPSR1
SCHEMBL6298575 0.80 SLC6A4 (0.32) MEN1KMT2ALMNAMAPK1NPSR1
Hydrochloric Acid SCHEMBL6297623 0.79 HTR1A (0.35) MEN1KMT2ALMNAMAPK1NPSR1
Hydrochloric Acid SCHEMBL6294439 0.79 MEN1 (0.33) MEN1KMT2ALMNAMAPK1NPSR1
Iodide SCHEMBL31409454 0.79 SLC6A4 (0.34) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL8430267 0.76 ALDH1A1 (0.43) ALDH1A1MAPK1NPSR1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1601382-A4 PHOSPHOLIPID SCRAMBLASE 3 UNIV UTAH RES FOUND (US) 2006-11-22 EP disclosed
US-20060172958-A1 Phospholipid scramblase 3 UNIVERSITY OF UTAH RESEARCH FOUNDATION 2006-08-03 US disclosed
EP-1601382-A2 PHOSPHOLIPID SCRAMBLASE 3 University of Utah Research Foundation (US) 2005-12-07 EP disclosed
WO-2004081200-A2 PHOSPHOLIPID SCRAMBLASE 3 UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2004-09-23 WO disclosed