SCHEMBL6415111

SCHEMBL6415111

O=C1NC(CN2CCC(Cc3cc(Cl)ccc3Cl)CC2)CN1C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.41
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
SLC6A4 P31645 2/20 0.37
CNR1 P21554 2/20 0.36
P2RX7 Q99572 1/20 0.35
HTR1A P08908 1/20 0.35
GPBAR1 Q8TDU6 2/20 0.35
MAPT P10636 1/20 0.34
FPR2 P25090 1/20 0.34
PROKR1 Q8TCW9 1/20 0.34
PDE9A O76083 1/20 0.34
CRHR1 P34998 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
SCHEMBL6410308 0.92 CCR3 (0.39) CCR3OPRM1OPRD1OPRK1OPRL1
SCHEMBL6412805 0.90 HTR1A (0.41) OPRM1OPRD1OPRK1OPRL1SLC6A4
SCHEMBL6415130 0.90 RAB9A (0.39) CCR3OPRM1OPRK1OPRL1SLC6A4
SCHEMBL6418232 0.88 HTR1A (0.51) CCR3OPRM1SLC6A4HTR1A
SCHEMBL6416518 0.86 HTR1A (0.41) SLC6A4HTR1AMAPT
SCHEMBL6418829 0.85 HTR1A (0.42) CCR3SLC6A4HTR1A
SCHEMBL6618151 0.84 CCR3 (0.38) CCR3OPRM1OPRD1OPRK1OPRL1
SCHEMBL6414602 0.82 HTR1A (0.41) OPRM1OPRD1OPRK1OPRL1SLC6A4
SCHEMBL6411807 0.82 RAB9A (0.38) CCR3OPRM1OPRK1OPRL1SLC6A4
SCHEMBL6413804 0.81 SLC6A4 (0.39) CCR3OPRM1OPRD1OPRK1OPRL1

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-20050065140-A1 Serotonine reuptake inhibitor SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2005-03-24 US disclosed
EP-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP 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-20050065140-A1 Serotonine reuptake inhibitor HTR1A, SLC6A4, SLC6A2 CCR3 4569/4885OPRM1 86/4885OPRD1 95/4885

“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.