SCHEMBL4246121

SCHEMBL4246121

O=C1NC(=O)C2(CC34CN(S(=O)(=O)c5ccc6cc(Cl)ccc6c5)CC(=O)N3CC3(CCN(Cc5ccccc5)CC3)N4)C=CC=CC12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.51
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 3/20 0.36
TRPV4 Q9HBA0 1/20 0.34
TSHR P16473 3/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD11B1 P28845 1/20 0.32
USP2 O75604 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
SLC2A1 P11166 1/20 0.31
CCR4 P51679 1/20 0.31
CD4 P01730 1/20 0.31
SORT1 Q99523 1/20 0.31

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
SCHEMBL4564514 0.82 F10 (0.60) F10ALDH1A1KDM4ETRPV4TSHR
SCHEMBL6078874 0.82 F10 (0.71) F10ALDH1A1KDM4ETRPV4TSHR
SCHEMBL4522849 0.81 F10 (0.58) F10ALDH1A1KDM4ETRPV4TSHR
SCHEMBL4452402 0.80 CYP2D6 (0.33) ALDH1A1TSHRMAPK1HSD11B1USP2
SCHEMBL7261609 0.80 F10 (0.57) F10ALDH1A1KDM4ETRPV4TSHR
SCHEMBL4529442 0.76 KDM4E (0.34) ALDH1A1KDM4ETRPV4TSHRUSP2
SCHEMBL6079458 0.71 F10 (0.44) F10ALDH1A1KDM4ETRPV4TSHR
SCHEMBL6079274 0.69 F10 (0.47) F10ALDH1A1KDM4ETRPV4TSHR
SCHEMBL4534417 0.69 F10 (0.45) F10ALDH1A1KDM4ETRPV4TSHR
SCHEMBL6079421 0.69 F10 (0.73) F10TRPV4

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-20090170844-A1 Spiro Tetracyclic Compound MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-07-02 US disclosed
EP-2020411-A1 SPIRO TETRACYCLIC COMPOUND MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-02-04 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-20090170844-A1 Spiro Tetracyclic Compound KCNH1, TFPI, KCNN2 F10 127/4885ALDH1A1 2243/4885KDM4E 2878/4885

“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.