SCHEMBL5422243

SCHEMBL5422243

N#CCCc1cc(F)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.42
MPO P05164 1/20 0.42
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KCNH2 Q12809 7/20 0.38
HTR2A P28223 6/20 0.38
PGR P06401 1/20 0.35
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
P2RX7 Q99572 2/20 0.33
CHEK1 O14757 1/20 0.33
HSD11B1 P28845 3/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 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
SCHEMBL5642630 0.81 KCNH2 (0.39) SLC6A4MPOMEN1KMT2AKCNH2
SCHEMBL4718190 0.81 MPO (0.44) SLC6A4MPOMEN1KMT2AFFAR1
SCHEMBL30192730 0.81 KCNH2 (0.39) SLC6A4MPOMEN1KMT2AKCNH2
SCHEMBL11058440 0.78 CYP3A4 (0.43) SLC6A4MEN1KMT2AHTR2ACHEK1
SCHEMBL31248059 0.78 MPO (0.42) SLC6A4MPOMEN1KMT2AHTR2A
SCHEMBL4717377 0.77 IDO1 (0.46) SLC6A4MPOMEN1KMT2AKCNH2
SCHEMBL14543571 0.76 MPO (0.41) SLC6A4MPOMEN1KMT2AFFAR1
SCHEMBL6985196 0.75 IDO1 (0.50) MEN1KMT2ACHEK1
SCHEMBL16961564 0.75 SLC6A4 (0.37) SLC6A4MPOMEN1KMT2AKCNH2
SCHEMBL19289777 0.75 KCNH2 (0.43) SLC6A4MPOKCNH2HTR2AP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
EP-1659123-A1 BICYCLIC PYRAZOLE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-05-24 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-20070082908-A1 Bicycle pyrazole derivative DPP4, DPP7, DPP3 SLC6A4 419/4885MPO 1294/4885MEN1 3555/4885

“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.