SCHEMBL20099569

SCHEMBL20099569

CN(CCC1CCCCN1)C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.40
CYP2D6 P10635 3/20 0.37
CYP1A2 P05177 2/20 0.37
KMT2A Q03164 2/20 0.37
SIGMAR1 Q99720 2/20 0.37
HTR1A P08908 2/20 0.37
HTR2A P28223 2/20 0.37
KCNH2 Q12809 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
MLNR O43193 1/20 0.37
ABCB11 O95342 1/20 0.37
EGFR P00533 1/20 0.37
FYN P06241 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37

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
SCHEMBL20099566 0.95 CHRNB4 (0.34) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL18353420 0.81 FDPS (0.42) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL18353417 0.81 FDPS (0.42) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL9120471 0.81 FDPS (0.42) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL22908385 0.81 CYP2D6 (0.41) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL4148616 0.81 CYP2D6 (0.41) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL18353418 0.76 FDPS (0.36) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL20099573 0.76 FDPS (0.36) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL18353686 0.76 FDPS (0.36) FDPSCYP2D6CYP1A2KMT2ASIGMAR1
SCHEMBL25566390 0.75 CYP2D6 (0.41) FDPSCYP2D6CYP1A2KMT2ASIGMAR1

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
US-9957267-B2 Somatostatin modulators and uses thereof Crinetics Pharmaceuticals, Inc. (US) 2018-05-01 US disclosed