Morpholine

Morpholine

SCHEMBL7574967

C1COCCN1.CCCCC(=O)Nc1ccc(C(=O)O)cc1[N+](=O)[O-]

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 12/20 0.55
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL7568813 0.88 HCAR3 (0.69) HCAR3MAPTKMT2AMEN1CRHBP
SCHEMBL7574965 0.78 MAPT (0.51) HCAR3MAPTKMT2AMEN1CRHBP
SCHEMBL9192581 0.77 MAPT (0.64) HCAR3MAPTKMT2AMEN1CRHBP
SCHEMBL6172138 0.77 HCAR3 (0.70) HCAR3MAPTKMT2AMEN1
Morpholine SCHEMBL28105354 0.76 TSHR (0.71) HCAR3MAPTKMT2AMEN1
SCHEMBL7572903 0.76 MAPT (0.56) HCAR3MAPTKMT2AMEN1CRHBP
SCHEMBL9043092 0.76 KMT2A (0.72) HCAR3MAPTKMT2AMEN1CRHBP
Morpholine SCHEMBL28035212 0.75 PLA2G4B (0.53) HCAR3MAPTKMT2AMEN1NPC1
Morpholine SCHEMBL28030087 0.75 TSHR (0.69) HCAR3MAPTKMT2AMEN1
SCHEMBL8396995 0.74 NPC1 (0.72) MAPTKMT2AMEN1CRHBPCRHR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0685470-B1 Benzene derivatives and pharmaceutical composition KUREHA CHEMICAL IND CO LTD (JP) 2002-09-11 EP disclosed
EP-0685470-A2 Benzene derivatives and pharmaceutical composition Kureha Chemical Industry Co., Ltd. (JP) 1995-12-06 EP disclosed