SCHEMBL4156385

SCHEMBL4156385

COC(=O)C1=C(C)CC2C3C=CC(C3)C12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.42
PKM P14618 1/20 0.39
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.38
ALDH1A1 P00352 6/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.36
HTT P42858 2/20 0.36
SLC6A3 Q01959 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL2705426 0.79 SMN1; SMN2 (0.50) SMN1; SMN2PKMTSHRHPGDALDH1A1
SCHEMBL17992238 0.76 SMN1; SMN2 (0.46) SMN1; SMN2PKMTSHRHPGDALDH1A1
SCHEMBL4100352 0.71 ALDH1A1 (0.33) SMN1; SMN2TSHRALDH1A1CYP3A4CYP2C19
SCHEMBL4099177 0.71 SMN1; SMN2 (0.42) SMN1; SMN2PKMTSHRHPGDALDH1A1
SCHEMBL16900345 0.68 SMN1; SMN2 (0.48) SMN1; SMN2PKMTSHRHPGDALDH1A1
SCHEMBL4162536 0.68 SMN1; SMN2 (0.36) SMN1; SMN2PKMTSHRHPGDALDH1A1
SCHEMBL7736774 0.66 SMN1; SMN2 (0.39) SMN1; SMN2PKMTSHRALDH1A1KDM4E
SCHEMBL24894937 0.64 SMN1; SMN2 (0.44) SMN1; SMN2PKMTSHRHPGDALDH1A1
SCHEMBL3443348 0.64 SMN1; SMN2 (0.47) SMN1; SMN2PKMTSHRHPGDALDH1A1
SCHEMBL12216989 0.63 ALDH1A1 (0.45) SMN1; SMN2PKMTSHRALDH1A1CYP3A4

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-1884519-B1 METAL HYDRIDE COMPLEX, METHOD OF HYDROGENATING RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN, AND PROCESS FOR PRODUCING PRODUCT OF HYDROGENATION OF RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN JSR CORP (JP) 2014-03-19 EP disclosed
US-20090176950-A1 METAL HYDRIDE COMPLEX, METHOD OF HYDROGENATING RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN, AND PROCESS FOR PRODUCING PRODUCT OF HYDROGENATION OF RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN JSR CORPORATION (JP) 2009-07-09 US disclosed
EP-1884519-A1 METAL HYDRIDE COMPLEX, METHOD OF HYDROGENATING RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN, AND PROCESS FOR PRODUCING PRODUCT OF HYDROGENATION OF RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN JSR Corporation (JP) 2008-02-06 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-20090176950-A1 METAL HYDRIDE COMPLEX, METHOD OF HYDROGENATING RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN, AND PROCESS FOR PRODUCING PRODUCT OF HYDROGENATION OF RING-OPENING POLYMERIZATION POLYMER OF CYCLOOLEFIN HPD, HMOX2, HAO2 SMN1; SMN2 4533/4885PKM 2562/4885TSHR 4545/4885

“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.