SCHEMBL7932134

SCHEMBL7932134

CCCCCOc1ccc(-c2ccc(CC(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.62
PLA2G4B P0C869 2/20 0.56
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
KDM4E B2RXH2 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
PDE4A P27815 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HIF1A Q16665 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
PTPN11 Q06124 1/20 0.52
LTA4H P09960 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51

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
SCHEMBL2354288 0.96 PLA2G4B (0.60) RARBPLA2G4BTP53TSHRKDM4E
SCHEMBL12733015 0.87 L3MBTL1 (0.58) PLA2G4BKDM4ECYP1A2CYP2D6PDE4A
SCHEMBL6201125 0.87 HRH2 (0.61) PLA2G4BTP53TSHRKDM4ECYP1A2
SCHEMBL13767448 0.84 RARB (0.59) RARBPLA2G4BTP53TSHRKDM4E
SCHEMBL31441005 0.83 RARB (0.54) RARBPLA2G4BKDM4ECYP1A2CYP2D6
SCHEMBL9000228 0.83 PLA2G4B (0.79) RARBPLA2G4BTP53TSHRKDM4E
SCHEMBL10347634 0.83 RARB (0.54) RARBTP53TSHRALDH1A1
SCHEMBL9361466 0.82 PPARA (0.49) PLA2G4B
SCHEMBL28567793 0.81 L3MBTL1 (0.62) KDM4ESMN1; SMN2LMNA
Bicarbonate SCHEMBL7805312 0.81 RARB (0.74) RARBPLA2G4BTP53TSHRHDAC10

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-20010020104-A1 Process for preparing substituted benzyl compounds and toluene derivatives CLARIANT GMBH 2001-09-06 US disclosed
EP-1127861-A1 Method to synthesise substituted benzyl and toluene compounds Clariant GmbH (DE) 2001-08-29 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-20010020104-A1 Process for preparing substituted benzyl compounds and toluene derivatives NISCH, TBCB, NBAS RARB 1694/4885PLA2G4B 4555/4885TP53 3645/4885

“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.