SCHEMBL9465620

SCHEMBL9465620

O=C1CCN(c2ccccc2)N1CCCl

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.40
GSK3B P49841 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
ALOX5 P09917 2/20 0.35
G6PD P11413 1/20 0.35
ALOX15 P16050 1/20 0.35
ALOX12 P18054 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL8831808 0.80 KCNH2 (0.36) MEN1KMT2ANPC1RAB9AALOX5
SCHEMBL9453365 0.79 MEN1 (0.38) GSK3BL3MBTL1MEN1KMT2ANPC1
SCHEMBL7099330 0.75 RAB9A (0.38) NPC1RAB9A
SCHEMBL10911511 0.73 HTR1A (0.43) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7738668 0.73 MEN1 (0.42) GSK3BMEN1KMT2ANPC1RAB9A
SCHEMBL9645284 0.72 L3MBTL1 (0.51) GSK3BL3MBTL1MEN1KMT2ANPC1
SCHEMBL10664727 0.72 MAPT (0.38) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL10407212 0.72 ALDH1A1 (0.43) L3MBTL1MEN1KMT2APOLBALDH1A1
SCHEMBL8592742 0.71 RAB9A (0.41) GSK3BMEN1KMT2ANPC1RAB9A
SCHEMBL5418407 0.71 MEN1 (0.43) GSK3BMEN1KMT2ANPC1RAB9A

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-RE34201-E Analgesics ANAQUEST, INC. (US) 1993-03-23 US disclosed
US-5053411-A Analgesics ANAQUEST, INC. (US) 1991-10-01 US disclosed
EP-0396282-A2 N-aryl-N-[4-(heterocyclicalkyl) piperidinyl]amides and pharmaceutical compositions and methods employing such compounds BOC, INC. (US) 1990-11-07 EP disclosed