SCHEMBL27770304

SCHEMBL27770304

CN1CCN(CC(=O)O)C(C)(c2ccccc2)C1c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.39
OPRK1 P41145 5/20 0.38
OPRM1 P35372 5/20 0.37
OPRD1 P41143 5/20 0.37
ATM Q13315 3/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
P2RX7 Q99572 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP3A4 P08684 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
POLB P06746 2/20 0.36
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35

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
Hydrochloric Acid SCHEMBL27749266 0.99 ATM (0.39) CHRM1OPRK1OPRM1OPRD1ATM
SCHEMBL27770310 0.74 OPRM1 (0.41) CHRM1OPRK1OPRM1OPRD1LMNA
Biphenyl SCHEMBL27679403 0.74 KCNN4 (0.37) CHRM1OPRK1OPRM1OPRD1ATM
SCHEMBL4297116 0.73 OPRM1 (0.38) OPRK1OPRM1OPRD1LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL27749268 0.73 OPRM1 (0.40) CHRM1OPRK1OPRM1OPRD1ATM
SCHEMBL16858836 0.67 ESR1 (0.37) CHRM1OPRK1ATMSMN1; SMN2CYP3A4
SCHEMBL27593886 0.66 NR1H2 (0.46)
SCHEMBL10688395 0.65 OPRK1 (0.40) CHRM1OPRK1OPRM1OPRD1ATM
SCHEMBL10691957 0.63 CHRNB2 (0.41) CHRM1OPRK1OPRM1OPRD1ATM
SCHEMBL16599372 0.61 CHRM1 (0.36) CHRM1ATMLMNANPSR1CHRNA7

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
CN-101479243-B Glycine transporter-1 inhibitors AMGEN INC 2013-01-02 CN claimed
CN-101479243-A Glycine transporter-1 inhibitors AMGEN INC (US) 2009-07-08 CN claimed