SCHEMBL4915657

SCHEMBL4915657

CCCNc1nc2ccccc2n1C1CC[N]CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGFRL1 Q5TC84 5/20 0.43
OPRM1 P35372 4/20 0.43
OPRK1 P41145 4/20 0.43
OPRL1 P41146 3/20 0.43
OPRD1 P41143 3/20 0.43
LCK P06239 1/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
HDAC3 O15379 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC10 Q969S8 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
TP53 P04637 2/20 0.40
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL4918096 0.90 TSHR (0.41) OGFRL1OPRM1OPRK1OPRL1OPRD1
SCHEMBL4918658 0.86 NR4A2 (0.45) OGFRL1OPRM1OPRK1OPRL1OPRD1
SCHEMBL4919026 0.82 OPRM1 (0.44) OGFRL1OPRM1OPRK1OPRL1OPRD1
SCHEMBL4909486 0.82 CYP1A2 (0.51) OGFRL1OPRM1OPRK1OPRL1OPRD1
SCHEMBL4917592 0.77 HDAC3 (0.56) OGFRL1HDAC3HDAC1HDAC10HDAC6
SCHEMBL4910139 0.77 NR4A2 (0.44) OGFRL1OPRM1OPRK1OPRL1OPRD1
SCHEMBL5114079 0.74 RAB9A (0.64) KDM4EALDH1A1MEN1KMT2ATP53
SCHEMBL7096897 0.72 OPRM1 (0.47) OGFRL1OPRM1OPRK1OPRL1OPRD1
SCHEMBL42480 0.72 TP53 (0.47) OGFRL1OPRM1OPRK1OPRL1OPRD1
SCHEMBL4918061 0.72 NR4A2 (0.46) OGFRL1OPRM1OPRK1OPRL1OPRD1

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-20080058376-A1 PIPERIDINES ICAGEN, INC. (US) 2008-03-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080058376-A1 PIPERIDINES TRPV3, SCN3A, TRPV1 OGFRL1 1754/4885OPRM1 339/4885OPRK1 191/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.