SCHEMBL14469475

SCHEMBL14469475

C=C/C=C(\C=C/N)CN1CCC(C(=O)N2CCN(Cc3ccc(F)c(F)c3)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.47
▸ DPP4 P27487 1/20 0.43
▸ DPP8 Q6V1X1 1/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ MTNR1B P49286 1/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ TSHR P16473 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL14469115 0.88 MEN1 (0.49) ALDH1A1KDM4ESIGMAR1MEN1KMT2A
SCHEMBL14469562 0.87 L3MBTL1 (0.47) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL14469179 0.86 ADRB2 (0.54) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL14469474 0.86 MTNR1B (0.49) ALDH1A1KDM4ETDP1SIGMAR1MTNR1B
SCHEMBL14469477 0.85 KMT2A (0.58) ALDH1A1KDM4EMEN1KMT2AALOX15
SCHEMBL14469464 0.85 MEN1 (0.45) ALDH1A1KDM4EMEN1KMT2AALOX15
SCHEMBL14469459 0.85 KDM4E (0.56) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL14469480 0.85 KMT2A (0.54) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL14469190 0.85 CYP3A4 (0.48) MEN1KMT2ATSHR
SCHEMBL14469285 0.84 L3MBTL1 (0.44) ALDH1A1KDM4EL3MBTL1MEN1KMT2A

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
WO-2007075555-A2 COMBINATION OF AN H3 ANTAGONIST/INVERSE AGONIST AND AN APPETITE SUPPRESSANT SCHERING CORPORATION (US) 2007-07-05 — — WO disclosed
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