SCHEMBL4597780

SCHEMBL4597780

CCOC(=O)C(CC1(c2cccc(Cl)c2OC)CC1)(O[Si](C)(C)C)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
HTT P42858 2/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 3/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
MAPT P10636 3/20 0.32
MAPK1 P28482 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
NPBWR1 P48145 1/20 0.31
MCHR1 Q99705 1/20 0.31
PDK2 Q15119 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
SCHEMBL3535798 0.84 ALDH1A1 (0.42) LMNAHTTNPSR1ALDH1A1HPGD
SCHEMBL3535800 0.82 ALDH1A1 (0.32) LMNAHTTKMT2AMEN1ALDH1A1
SCHEMBL3537354 0.79 ALDH1A1 (0.40) LMNAHTTGAANPSR1ALDH1A1
SCHEMBL3537355 0.77 P2RX7 (0.34) LMNAHTTKMT2AMEN1ALDH1A1
SCHEMBL3535355 0.73 KCNA3 (0.31) PDK2
SCHEMBL1260201 0.72 ALDH1A1 (0.43) LMNAHTTNPSR1ALDH1A1MAPT
SCHEMBL3530707 0.72 GPR35 (0.36) LMNAGAANPSR1KMT2AMEN1
SCHEMBL5920339 0.69 KDM4E (0.32) LMNAGAANPSR1KMT2AMEN1
SCHEMBL30885346 0.69 ALDH1A1 (0.39) HTTNPSR1KMT2AALDH1A1HPGD
SCHEMBL3534635 0.68 P2RX7 (0.34) KMT2AMEN1

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
EP-1786823-B1 ALKYLIDENE TETRAHYDRONAPHTHALENE DERIVATIVES, METHOD FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS BAYER SCHERING PHARMA AG (DE) 2008-01-16 EP disclosed
US-20060084652-A1 Alkylidene-tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents SCHERING AG (DE) 2006-04-20 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-20060084652-A1 Alkylidene-tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents PTGES, PTGS1, PTGES2 LMNA 3160/4885HTT 607/4885GAA 2648/4885

“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.