SCHEMBL25518294

SCHEMBL25518294

OC(c1ccc(Cl)cc1)C1(c2cccc(Cl)c2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.40
SLC6A3 Q01959 6/20 0.40
OPRM1 P35372 2/20 0.39
OPRD1 P41143 2/20 0.39
OPRK1 P41145 2/20 0.39
OPRL1 P41146 2/20 0.39
SLC6A2 P23975 6/20 0.37
CCR2 P41597 1/20 0.36
MAP3K14 Q99558 1/20 0.35
TRPV3 Q8NET8 1/20 0.35
HTR2C P28335 2/20 0.34
CHRNA1 P02708 2/20 0.34
CHRNG P07510 2/20 0.34
CHRNB1 P11230 2/20 0.34
CHRNB2 P17787 2/20 0.34
CHRNB4 P30926 2/20 0.34
CHRNA3 P32297 2/20 0.34
CHRNA4 P43681 2/20 0.34
CHRND Q07001 2/20 0.34
HTR2A P28223 1/20 0.34

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
SCHEMBL30174956 1.00 SLC6A4 (0.40) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL25518334 0.89 OPRM1 (0.46) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL30174859 0.89 OPRM1 (0.46) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL31332725 0.78 CCR2 (0.44) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL31376788 0.75 PARP1 (0.39) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL20684979 0.74 SLC6A3 (0.45) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL5755205 0.68 OPRD1 (0.43) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL1155345 0.67 OPRM1 (0.50) SLC6A4SLC6A3OPRM1OPRD1OPRK1
SCHEMBL6002784 0.66 ACP3 (0.44) OPRM1OPRD1OPRK1OPRL1TSHR
SCHEMBL12321361 0.66 IDO1 (0.42) SLC6A4SLC6A3OPRM1OPRD1OPRK1

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
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-25 US disclosed
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-25 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-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION VIM, ACE, ACE2 SLC6A4 3646/4885SLC6A3 4044/4885OPRM1 1969/4885

“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.