SCHEMBL3373687

SCHEMBL3373687

CCCCN(CC)[C]1CC1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
CRHR1 P34998 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA9 Q16790 2/20 0.31
CA2 P00918 1/20 0.31
HTT P42858 2/20 0.30
ALDH1A1 P00352 1/20 0.30
NCOA1 Q15788 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NCOA3 Q9Y6Q9 1/20 0.30

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
SCHEMBL3375790 0.91 CNR2 (0.33) MAPTCYP3A4MAPK1CRHR1KDM4E
SCHEMBL3374354 0.85 HTT (0.30) HTTNCOA1SMN1; SMN2NCOA3
SCHEMBL3370176 0.84
SCHEMBL3372778 0.80 MAPT (0.32) MAPTKDM4EHTTNCOA1SMN1; SMN2
SCHEMBL3373140 0.75
SCHEMBL3376546 0.73 MAPT (0.33) MAPTCA12CA1CA2SMN1; SMN2
SCHEMBL3373523 0.72 NR1H2 (0.50) MAPTMAPK1CRHR1KDM4EMEN1
SCHEMBL3376058 0.72
SCHEMBL4722692 0.70 MAPT (0.31) MAPTCYP3A4MAPK1CRHR1KDM4E
SCHEMBL4722149 0.70 CYP1A2 (0.32) MAPTCYP3A4MAPK1CRHR1HPGD

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-20100324091-A1 Pyrazolone Derivative KOWA COMPANY, LTD. (JP) 2010-12-23 US disclosed
EP-2172458-A1 PYRAZOLONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-04-07 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-20100324091-A1 Pyrazolone Derivative SERPINE1, SERPINC1, TFPI MAPT 2810/4885CYP3A4 710/4885MAPK1 448/4885

“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.