SCHEMBL6413804

SCHEMBL6413804

O=C1SC(CN2CCC(Cc3cc(Cl)ccc3Cl)CC2)CN1C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.39
CCR3 P51677 1/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
OPRM1 P35372 2/20 0.36
OPRL1 P41146 2/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
EPHX2 P34913 1/20 0.35
P2RX7 Q99572 1/20 0.35
HTR1A P08908 1/20 0.34
GPBAR1 Q8TDU6 2/20 0.34
MAPT P10636 1/20 0.34
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
KCNH2 Q12809 1/20 0.34
CNR1 P21554 1/20 0.33
UTS2R Q9UKP6 1/20 0.33

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
SCHEMBL6410927 0.90 RAB9A (0.37) SLC6A4CCR3OPRM1OPRL1OPRK1
SCHEMBL6414992 0.90 HTR1A (0.40) SLC6A4OPRM1OPRL1OPRD1OPRK1
SCHEMBL6417631 0.88 HTR1A (0.50) SLC6A4CCR3MEN1POLBKMT2A
SCHEMBL6415004 0.86 HTR1A (0.41) SLC6A4HTR1AMAPT
SCHEMBL6410453 0.85 HTR1A (0.41) SLC6A4CCR3HTR1A
SCHEMBL6413041 0.82 MEN1 (0.39) SLC6A4CCR3MEN1POLBKMT2A
SCHEMBL6416434 0.82 MEN1 (0.41) SLC6A4CCR3MEN1POLBKMT2A
SCHEMBL6414018 0.81 HTR1A (0.43) SLC6A4HTR1AKCNH2
SCHEMBL6415111 0.81 CCR3 (0.41) SLC6A4CCR3OPRM1OPRL1OPRD1
SCHEMBL6411542 0.81 CCR3 (0.39) SLC6A4CCR3MEN1POLBKMT2A

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 SLC6A4 2/4885CCR3 4569/4885MEN1 2067/4885

“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.