SCHEMBL6096441

SCHEMBL6096441

Cc1ccc2c(c1)COC2c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.49
SLC6A4 P31645 8/20 0.49
SLC6A3 Q01959 8/20 0.49
CYP2D6 P10635 1/20 0.49
MAOB P27338 1/20 0.39
ACHE P22303 1/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTR7 P34969 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
SCHEMBL1777 0.81 KDM1A (0.35) SLC6A4HTR7
SCHEMBL6655779 0.81 NR3C1 (0.33) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL27947259 0.81 CA1 (0.47) SLC6A2SLC6A4SLC6A3MAOBHTR7
SCHEMBL13970077 0.79 SLC5A2 (0.38) SLC6A2SLC6A4SLC6A3CYP2D6MAPT
SCHEMBL4620798 0.78 SLC5A2 (0.35) SLC6A2SLC6A4SLC6A3
SCHEMBL4622359 0.78 LOXL2 (0.46) SLC6A2SLC6A4SLC6A3MAOB
SCHEMBL1686 0.78 FADS1 (0.40) SLC6A2SLC6A4SLC6A3CYP2D6ACHE
SCHEMBL4622856 0.78 SLC5A2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL22043585 0.78 FADS1 (0.40) SLC6A2SLC6A4SLC6A3CYP2D6ACHE
SCHEMBL5936386 0.78 MEN1 (0.38) MAOBMAPTTDP1L3MBTL1

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-7119215-B2 Production method of citalopram, intermediate therefor and production method of the intermediate SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2006-10-10 US disclosed
US-20020095051-A1 Production method of citalopram, intermediate therefor and production method of the intermediate SUMIKA FINE CHEMICALS CO., LTD. (JP) 2002-07-18 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-20020095051-A1 Production method of citalopram, intermediate therefor and production method of the intermediate INMT, FAR1, CYP51A1 SLC6A2 309/4885SLC6A4 46/4885SLC6A3 217/4885

“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.