SCHEMBL6707976

SCHEMBL6707976

OC1(c2csc3ccccc23)CCN(Cc2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.57
POLB P06746 1/20 0.56
CCR3 P51677 1/20 0.52
CYP3A4 P08684 1/20 0.49
HSD17B10 Q99714 1/20 0.49
SIGMAR1 Q99720 2/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
CHRNA7 P36544 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL11877743 0.79 CHRM2 (0.51) OPRL1HSD17B10CHRM2CHRM4CHRM5
SCHEMBL6911078 0.77 OPRL1 (0.71) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL6709096 0.77 OPRL1 (0.63) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL2877688 0.75 OPRL1 (0.77) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL3216799 0.74 OPRM1 (0.47) OPRL1CHRM2CHRM4CHRM5CHRM1
SCHEMBL1411499 0.74 OPRL1 (1.00) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL2883677 0.73 OPRL1 (0.66) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL10916463 0.73 OPRL1 (0.70) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL6042326 0.73 OPRL1 (0.66) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL6042648 0.73 OPRL1 (0.56) OPRL1POLBCCR3CYP3A4HSD17B10

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-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression SMITHKLINE BEECHAM CORPORATION 2004-04-22 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-20040077654-A1 Aryl piperidine and piperazine derivatives as inducers of ldl-receptor expression LDLR, NR1H2, NCOR1 OPRL1 303/4885POLB 3619/4885CCR3 2355/4885

“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.