SCHEMBL4473145

SCHEMBL4473145

COc1cc2c(c(C)c1C)N(c1ccc(Cl)cc1)CC1(CCC1)C2=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DOCK5 Q9H7D0 1/20 0.34
F10 P00742 1/20 0.34
CMA1 P23946 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
ALDH1A1 P00352 4/20 0.33
AMY1A P0DUB6 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD11B1 P28845 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 1/20 0.32
MAPT P10636 1/20 0.32
MALT1 Q9UDY8 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
SCHEMBL4478379 0.84 LMNA (0.34) F10SMN1; SMN2HSD11B1POLB
SCHEMBL4473196 0.82 NPC1 (0.32) ALDH1A1AMY1ASMN1; SMN2HSD11B1KDM4E
SCHEMBL4466246 0.74 HSD11B1 (0.32) ALDH1A1SMN1; SMN2HSD11B1RAB9AMAPT
SCHEMBL4462793 0.67 CYP11B2 (0.31)
SCHEMBL4469308 0.65 KDM4E (0.35) ALDH1A1KDM4EPOLBRAB9AMALT1
SCHEMBL1608784 0.63 HTR2C (0.50) CMA1HTR2AHTR2CHTR2BPOLB
SCHEMBL4472455 0.60 SPR (0.34) SMN1; SMN2POLB
SCHEMBL4470762 0.59 CYP11B2 (0.34)
SCHEMBL11814298 0.58 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2HSD11B1MAPK1POLB
SCHEMBL4727877 0.56 NPC1 (0.78) HTR2AHTR2CHTR2BALDH1A1SMN1; SMN2

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-7576094-B2 Spiro derivatives as lipoxygenase inhibitors ELI LILLY AND COMPANY (US) 2009-08-18 US disclosed
US-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors GALILEO PHARMACEUTICALS, INC. 2006-06-15 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-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors ALOX15B, ALOX5, ALOX15 DOCK5 2581/4885F10 3476/4885CMA1 1319/4885

“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.