SCHEMBL6098689

SCHEMBL6098689

[C]1N(c2ccccc2)CCCN1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 2/20 0.38
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
ADRB1 P08588 1/20 0.38
HTR3A P46098 1/20 0.38
HTR3D Q70Z44 1/20 0.38
HTR3C Q8WXA8 1/20 0.38
RECQL P46063 1/20 0.38
MBTD1 Q05BQ5 1/20 0.36
L3MBTL3 Q96JM7 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP3A4 P08684 3/20 0.35
CHRNA7 P36544 2/20 0.35
ALOX15 P16050 1/20 0.35
CHRNB2 P17787 1/20 0.35

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
SCHEMBL1006035 0.90 SIGMAR1 (0.42) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL16924863 0.70 LMNA (0.61) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL2052260 0.70 SMN1; SMN2 (0.44) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL569307 0.70 LMNA (0.61) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL577708 0.69 LMNA (0.58) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL576673 0.69 LMNA (0.58) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL14500221 0.69 LMNA (0.58) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL2046994 0.67 LMNA (0.50) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL20396065 0.65 SIGMAR1 (0.39) SIGMAR1MEN1KMT2ANPC1RAB9A
SCHEMBL18228234 0.65 L3MBTL1 (0.61) SIGMAR1MEN1KMT2ANPC1RAB9A

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-7084222-B2 Ruthenium complexes, process for preparation thereof, and processes for producing open-ring polymer of cycloolefins and hydrogenation products thereof by using the complex as catalyst ZEON CORPORATION (JP) 2006-08-01 US disclosed