SCHEMBL6411542

SCHEMBL6411542

CC(C)N1CC(CN2CCC(Cc3cc(Cl)ccc3Cl)CC2)SC1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.39
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC6A4 P31645 2/20 0.37
HTR1A P08908 1/20 0.37
P2RX7 Q99572 1/20 0.34
CNR1 P21554 1/20 0.34
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
XIAP P98170 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 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
SCHEMBL6416736 0.90 CCR3 (0.36) CCR3MEN1KMT2ASLC6A4HTR1A
SCHEMBL6420406 0.90 HTR1A (0.43) SLC6A4HTR1ANOS3NOS1NOS2
SCHEMBL6411174 0.88 HTR1A (0.52) CCR3MEN1POLBKMT2ASLC6A4
SCHEMBL6417229 0.88 HTR1A (0.43) CCR3SLC6A4HTR1A
SCHEMBL6413917 0.87 HTR1A (0.42) CCR3POLBSLC6A4HTR1A
SCHEMBL6413041 0.83 MEN1 (0.39) CCR3MEN1POLBKMT2ASLC6A4
SCHEMBL6412125 0.83 CCR3 (0.38) CCR3MEN1POLBKMT2ASLC6A4
SCHEMBL6416434 0.82 MEN1 (0.41) CCR3MEN1POLBKMT2ASLC6A4
SCHEMBL6413804 0.81 SLC6A4 (0.39) CCR3MEN1POLBKMT2ASLC6A4
SCHEMBL6416360 0.81 SLC6A4 (0.40) CCR3MEN1POLBKMT2ASLC6A4

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 4569/4885MEN1 2067/4885POLB 2604/4885

“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.