SCHEMBL24489451

SCHEMBL24489451

CCCN1CCC(O)(c2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.65
SIGMAR1 Q99720 1/20 0.65
POLB P06746 1/20 0.61
DRD2 P14416 1/20 0.58
OPRM1 P35372 4/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
CCR3 P51677 2/20 0.56
OPRD1 P41143 3/20 0.56
OPRK1 P41145 3/20 0.56
KCNA3 P22001 1/20 0.56

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
SCHEMBL11778752 0.90 SIGMAR1 (0.70) OPRL1SIGMAR1POLBDRD2OPRM1
SCHEMBL8213555 0.86 OPRL1 (0.67) OPRL1SIGMAR1POLBDRD2OPRM1
SCHEMBL10287607 0.85 OPRM1 (0.63) OPRL1DRD2OPRM1CCR3
Hydrochloric Acid SCHEMBL29777982 0.84 POLB (0.68) OPRL1SIGMAR1POLBDRD2OPRM1
SCHEMBL4684452 0.83 DRD2 (0.56) SIGMAR1DRD2OPRM1MEN1KMT2A
SCHEMBL2059079 0.83 OPRL1 (0.68) OPRL1SIGMAR1POLBDRD2OPRM1
SCHEMBL1307928 0.83 OPRL1 (0.65) OPRL1SIGMAR1POLBDRD2OPRM1
SCHEMBL3867146 0.82 OPRM1 (0.55) OPRL1SIGMAR1DRD2OPRM1
Hydrochloric Acid SCHEMBL28638282 0.82 OPRL1 (0.54) OPRL1SIGMAR1POLBDRD2OPRM1
SCHEMBL9370237 0.81 SIGMAR1 (0.72) OPRL1SIGMAR1POLBDRD2MEN1

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
EP-3325443-B1 PROCESS FOR PREPARING PRIDOPIDINE Prilenia Neurotherapeutics Ltd (IL) 2022-06-08 EP disclosed