SCHEMBL27433340

SCHEMBL27433340

CC(=O)NCC1=CCCCC1(C)N

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.34
KMT2A Q03164 1/20 0.33
CCR2 P41597 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
ALOX15 P16050 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31
TSHR P16473 1/20 0.31
CASP1 P29466 1/20 0.31
MTNR1A P48039 1/20 0.31

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
SCHEMBL27433342 0.86 KDM4E (0.32) KMT2ACCR2ALOX15ALDH1A1RAB9A
SCHEMBL27433336 0.80
SCHEMBL27433338 0.77
SCHEMBL27433419 0.73
SCHEMBL27433255 0.65 NPSR1 (0.34) NPSR1KMT2AHDAC1HDAC6ALDH1A1
SCHEMBL27433421 0.63
SCHEMBL27433423 0.61
SCHEMBL12070763 0.60 TSHR (0.40) NPSR1OPRM1OPRL1ALDH1A1TSHR
SCHEMBL22114518 0.59
SCHEMBL13016521 0.59 NPSR1 (0.38) NPSR1KMT2AHDAC1HDAC6ALOX15

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-2024135498-A1 RESIST COMPOSITION, RESIST PATTERN FORMATION METHOD, AND COMPOUND 東京応化工業株式会社 2024-06-27 WO disclosed