SCHEMBL4613473

SCHEMBL4613473

CCCCCc1oc2ccccc2c(=O)c1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.60
PTPN1 P18031 5/20 0.56
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
MAPT P10636 1/20 0.52
EYA3 Q99504 2/20 0.45
CYP2C9 P11712 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.43
PLA2G2A P14555 1/20 0.43
PLA2G4A P47712 1/20 0.43
DDR2 Q16832 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
CA12 O43570 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
ABCB1 P08183 1/20 0.42
CYP3A4 P08684 1/20 0.42
CALM1 P0DP23 1/20 0.42
AR P10275 1/20 0.42

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
SCHEMBL8612 0.90 CA1 (0.56) PPARGPTPN1CA1CA2MAPT
SCHEMBL9595 0.84 CA1 (0.54) PPARGPTPN1CA1CA2MAPT
SCHEMBL15528187 0.84 CA1 (0.54) PPARGPTPN1CA1CA2MAPT
SCHEMBL8733 0.84 CA1 (0.59) CA1CA2MAPTEYA3CYP2C9
SCHEMBL15527966 0.81 CA1 (0.56) PPARGPTPN1CA1CA2MAPT
SCHEMBL9311 0.81 CA1 (0.56) PTPN1CA1CA2MAPTABCG2
SCHEMBL7855340 0.81 PTPN1 (0.82) PPARGPTPN1MAPTEYA3
SCHEMBL4875780 0.81 MAPT (0.51) PPARGPTPN1CA1CA2MAPT
SCHEMBL10716 0.81 MAPK14 (0.53) PPARGPTPN1CA1CA2MAPT
SCHEMBL18407427 0.80 EYA3 (0.50) PPARGPTPN1MAPTEYA3CYP2C9

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1281324-B1 Health food products DAICHO KIKAKU INC COMPANY (JP) 2008-04-16 EP claimed
US-20050058733-A1 Health food products DAICHO KIKAKU INCORPORATED COMPANY (JP) 2005-03-17 US claimed
US-20030157199-A1 Health food products DAICHO KIKAKU INCORPORATED COMPANY (JP) 2003-08-21 US claimed
EP-1281324-A2 Health food products Daicho Kikaku Incorporated Company (JP) 2003-02-05 EP claimed
EP-2865421-B1 Bitter taste receptor agonists for topical use UNIV FREIBURG ALBERT LUDWIGS (DE) 2018-05-30 EP disclosed
EP-1281324-B1 Health food products DAICHO KIKAKU INC COMPANY (JP) 2008-04-16 EP disclosed
JP-2005281280-A DERMATOLOGIC PREPARATION DAICHO KIKAKU:KK 2005-10-13 JP disclosed
US-20050058733-A1 Health food products DAICHO KIKAKU INCORPORATED COMPANY (JP) 2005-03-17 US disclosed
JP-2004210656-A PREPARATION FOR SKIN DAICHO KIKAKU:KK 2004-07-29 JP disclosed
JP-2004182600-A PREPARATION FOR SKIN DAICHO KIKAKU:KK 2004-07-02 JP disclosed
US-20030157199-A1 Health food products DAICHO KIKAKU INCORPORATED COMPANY (JP) 2003-08-21 US disclosed
EP-1281324-A2 Health food products Daicho Kikaku Incorporated Company (JP) 2003-02-05 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 (2 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-20030157199-A1 Health food products MUSK, TAS1R1, TAS1R2 PPARG 1152/4885PTPN1 2108/4885CA1 3368/4885
US-20050058733-A1 Health food products MUSK, TAS1R1, TAS1R2 PPARG 1152/4885PTPN1 2108/4885CA1 3368/4885

“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.