SCHEMBL3475848

SCHEMBL3475848

CCCCCCCCNc1cccc(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.61
ABL1 P00519 1/20 0.59
EPHX2 P34913 6/20 0.53
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL2920696 0.98 EPHX1 (0.59) EPHX1ABL1EPHX2ALDH1A1MAPT
SCHEMBL11522061 0.95 EPHX1 (0.55) EPHX1ABL1EPHX2ALDH1A1MAPT
SCHEMBL4410502 0.87 MAPT (0.51) EPHX1ABL1EPHX2ALDH1A1MAPT
SCHEMBL3662823 0.87 ABL1 (0.54) EPHX1ABL1ALDH1A1MAPT
SCHEMBL11115361 0.87 MAPT (0.54) EPHX1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL21248323 0.85 MAPT (0.50) EPHX1ABL1EPHX2ALDH1A1MAPT
SCHEMBL14149930 0.85 ABL1 (0.48) EPHX1ABL1EPHX2ALDH1A1MAPT
SCHEMBL10439139 0.84 ABL1 (0.54) EPHX1ABL1ALDH1A1MAPT
SCHEMBL22176875 0.84 ABL1 (0.53) EPHX1ABL1ALDH1A1MAPT
SCHEMBL30288302 0.83 ABL1 (0.56) EPHX1ABL1EPHX2ALDH1A1

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-20110313158-A1 Two Component Recyclable Heterogeneous Catalyst, Process for Preparation Thereof and its Use for Preparation of Amines COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2011-12-22 US claimed
WO-2010097815-A2 A TWO COMPONENT RECYCLABLE HETEROGENEOUS CATALYST, PROCESS FOR PREPARATION THEREOF AND ITS USE FOR PREPARATION OF AMINES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-09-02 WO claimed
US-20110313158-A1 Two Component Recyclable Heterogeneous Catalyst, Process for Preparation Thereof and its Use for Preparation of Amines COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2011-12-22 US disclosed
WO-2010097815-A2 A TWO COMPONENT RECYCLABLE HETEROGENEOUS CATALYST, PROCESS FOR PREPARATION THEREOF AND ITS USE FOR PREPARATION OF AMINES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-09-02 WO 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-20110313158-A1 Two Component Recyclable Heterogeneous Catalyst, Process for Preparation Thereof and its Use for Preparation of Amines HCN2, RAC2, HCN1 EPHX1 636/4885ABL1 211/4885EPHX2 121/4885

“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.