SCHEMBL6417606

SCHEMBL6417606

O=C1SC(CN2CCC(Cc3cc(F)ccc3Cl)CC2)CN1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.41
SLC6A4 P31645 2/20 0.39
HTR1A P08908 1/20 0.39
ATM Q13315 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TMEM97 Q5BJF2 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
OPRM1 P35372 1/20 0.35
CCR3 P51677 1/20 0.35
SLC6A2 P23975 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
SCHEMBL6415056 0.92 GRIN1 (0.35) P2RX7SLC6A4HTR1AMEN1KMT2A
SCHEMBL6416360 0.90 SLC6A4 (0.40) SLC6A4HTR1AATMALDH1A1MEN1
SCHEMBL6415371 0.89 SLC6A4 (0.41) SLC6A4HTR1AATMTMEM97SIGMAR1
SCHEMBL6413561 0.88 HTR1A (0.44) P2RX7SLC6A4HTR1ASIGMAR1CCR3
SCHEMBL6414071 0.86 HTR1A (0.57) SLC6A4HTR1AMEN1KMT2ASIGMAR1
SCHEMBL6410354 0.86 ATM (0.43) SLC6A4HTR1AATMALDH1A1MEN1
SCHEMBL6416461 0.84 HTR1A (0.46) SLC6A4HTR1AATMALDH1A1CCR3
SCHEMBL6416434 0.84 MEN1 (0.41) SLC6A4HTR1AALDH1A1MEN1KMT2A
SCHEMBL6417947 0.84 HTR1A (0.46) SLC6A4HTR1AMEN1KMT2ACCR3
SCHEMBL6413207 0.83 CCR3 (0.37) SLC6A4HTR1ASIGMAR1HTR2AHTR2C

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 P2RX7 597/4885SLC6A4 2/4885HTR1A 1/4885

“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.