SCHEMBL7121491

SCHEMBL7121491

C=CCc1cc(Cc2ccccc2)ccc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.58
GABRA1 P14867 4/20 0.56
GABRB2 P47870 4/20 0.56
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
POLB P06746 2/20 0.53
GAA P10253 2/20 0.53
MAPT P10636 2/20 0.53
CNR1 P21554 2/20 0.53
CNR2 P34972 2/20 0.53
ALOX5 P09917 2/20 0.53
GABRB1 P18505 1/20 0.53
RXRA P19793 1/20 0.53
GABRA5 P31644 1/20 0.53
GABRA3 P34903 1/20 0.53
GABRA2 P47869 1/20 0.53
ACE2 Q9BYF1 1/20 0.53
SIRT3 Q9NTG7 1/20 0.53
HNF4A P41235 1/20 0.50
XDH P47989 1/20 0.49

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
SCHEMBL240238 0.91 GABRA1 (0.66) IDH1GABRA1GABRB2MEN1KMT2A
SCHEMBL29463215 0.91 GABRA1 (0.66) IDH1GABRA1GABRB2MEN1KMT2A
SCHEMBL20684743 0.89 GABRA1 (0.59) IDH1GABRA1GABRB2MEN1KMT2A
SCHEMBL9558546 0.88 GABRA1 (0.58) IDH1GABRA1GABRB2MEN1KMT2A
SCHEMBL10688359 0.87 XDH (0.58) IDH1GABRA1GABRB2MEN1KMT2A
Diphenylmethane SCHEMBL28353526 0.84 KEAP1 (0.48) IDH1GABRA1GABRB2MEN1KMT2A
SCHEMBL9404591 0.83 PTPN1 (0.50) IDH1GABRA1GABRB2MEN1KMT2A
SCHEMBL821126 0.82 GABRA1 (0.72) GABRA1GABRB2MEN1KMT2APOLB
SCHEMBL8759223 0.82 IDH1 (0.70) IDH1MEN1KMT2AMAPTALOX5
SCHEMBL10886054 0.82 IDH1 (0.70) IDH1MEN1KMT2AMAPTALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6670474-B2 Such as bis-1,2-(2-(2,3-epoxypropyl)phenoxy)ethane; chemical intermediates for formation of epoxy resins PEWS R GARTH (US) 2003-12-30 US disclosed
US-20020151731-A1 Novel epoxide derivatives of allylarylphenols PEWS R GARTH (US) 2002-10-17 US disclosed
US-4532367-A Antimicrobially effective derivatives of phenol and methods for their production VEB JENAPHARM (DD) 1985-07-30 US disclosed
US-4532367-A Antimicrobially effective derivatives of phenol and methods for their production VEB JENAPHARM (DD) 1985-07-30 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-20020151731-A1 Novel epoxide derivatives of allylarylphenols EPHX2, CBR3, CYP4X1 IDH1 1538/4885GABRA1 2014/4885GABRB2 2055/4885

“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.