SCHEMBL26611978

SCHEMBL26611978

COc1ccc(OC)c(CCNC(=O)O)n1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 11/20 0.45
MTNR1B P49286 11/20 0.45
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL26698651 0.82 MTNR1A (0.45) MTNR1AMTNR1B
SCHEMBL26931313 0.80 TXNRD1 (0.52) NPC1RAB9A
SCHEMBL26611752 0.75 SMN1; SMN2 (0.39) MTNR1AMTNR1BNPC1RAB9ACA12
SCHEMBL26612125 0.74 NNMT (0.40) POLBTDP1
SCHEMBL26611992 0.74 SMN1; SMN2 (0.44) MTNR1AMTNR1BNPC1RAB9APOLB
SCHEMBL8785416 0.73 PDE4B (0.41) POLBTDP1
SCHEMBL26611719 0.73 MTNR1A (0.39) MTNR1AMTNR1BRAB9ACA1CA2
SCHEMBL26611757 0.73 SMN1; SMN2 (0.43) MTNR1AMTNR1BPOLB
SCHEMBL20562599 0.73 MTNR1A (0.56) MTNR1AMTNR1B
SCHEMBL27447499 0.73 KDM4E (0.46) TAAR1

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-2023205116-A1 PYRIDINE DERIVATIVES FOR TREATING PSYCHIATRIC DISORDERS GILGAMESH PHARMACEUTICALS, INC. (US) 2023-10-26 WO disclosed