SCHEMBL10912079

SCHEMBL10912079

CN1CCN(CCOc2cccc3c2C(=O)N(CCO[N+](=O)[O-])C3=O)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 0.45
▸ NPC1 O15118 4/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ HPGD P15428 2/20 0.44
▸ TSHR P16473 2/20 0.44
▸ ALDH1A1 P00352 6/20 0.43
▸ LMNA P02545 1/20 0.43
▸ AGTR1 P30556 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.41
▸ ATM Q13315 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPK1 P28482 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PRKDC P78527 1/20 0.38

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
SCHEMBL10912841 0.92 RAB9A (0.47) RAB9ANPC1KMT2AMEN1HPGD
SCHEMBL10912207 0.91 RAB9A (0.46) RAB9ANPC1KMT2AMEN1HPGD
SCHEMBL10911850 0.88 HRH2 (0.47) RAB9ANPC1KMT2AMEN1HPGD
SCHEMBL10912510 0.86 KDM4E (0.45) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL10909796 0.85 KDM4E (0.44) RAB9ANPC1KMT2AMEN1TSHR
SCHEMBL10947007 0.84 KMT2A (0.44) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL10911891 0.84 KDM4E (0.44) RAB9ANPC1KMT2AMEN1TSHR
SCHEMBL10914105 0.83 CYP2D6 (0.51) RAB9ANPC1KMT2AMEN1TSHR
SCHEMBL10912179 0.82 KMT2A (0.45) RAB9ANPC1KMT2AMEN1ALDH1A1
SCHEMBL10914068 0.82 PABPC1 (0.45) RAB9ANPC1KMT2AMEN1HPGD

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
EP-0171977-A1 Phthalimide derivatives, compositions containing them and a process for preparing them SANKYO COMPANY LIMITED (JP) 1986-02-19 — — EP disclosed
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