SCHEMBL640922

SCHEMBL640922

O=Cc1ccccc1N1CCC(NCc2ccccc2Oc2ccc(Cl)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.46
HTR2A P28223 2/20 0.46
KMT2A Q03164 5/20 0.42
MEN1 O00255 3/20 0.42
POLB P06746 1/20 0.42
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
BCHE P06276 3/20 0.38
ACHE P22303 3/20 0.38
BACE1 P56817 3/20 0.38
MAPT P10636 2/20 0.38
MITF O75030 1/20 0.38
ATM Q13315 1/20 0.38
MAPK14 Q16539 2/20 0.37
CCR8 P51685 1/20 0.37
KCNH2 Q12809 1/20 0.37
TACR1 P25103 1/20 0.37
HTT P42858 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
LMNA P02545 3/20 0.36

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
SCHEMBL642225 0.78 SLC6A4 (0.45) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL642465 0.78 SLC6A4 (0.52) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL641548 0.77 HTR2A (0.44) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL640921 0.76 CCR8 (0.57) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL641796 0.76 SLC6A4 (0.50) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL642224 0.76 SLC6A4 (0.46) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL641547 0.75 KMT2A (0.46) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL9965443 0.75 SLC6A4 (0.48) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL641293 0.74 SLC6A4 (0.47) SLC6A4HTR2AKMT2AMEN1POLB
SCHEMBL5072840 0.73 MEN1 (0.47) SLC6A4HTR2AKMT2AMEN1POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960347-B1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 3 (17BETA-HSD3) INHIBITORS STERIX LTD (GB) 2012-06-20 EP disclosed
US-8119627-B2 Heterocyclic compounds as inhibitors of 17beta-HSD3 STERIX LIMITED (GB) 2012-02-21 US disclosed
US-20090023710-A1 Compound OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2009-01-22 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-20090023710-A1 Compound NR1H3, NR1H2, NR1H4 SLC6A4 912/4885HTR2A 636/4885KMT2A 1997/4885

“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.