SCHEMBL16210367

SCHEMBL16210367

CC(OC(=O)Nc1c(-c2ccc(-c3ccc(B(O)O)cc3)cc2)ncn1C)c1ccccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 17/20 0.54
LPAR3 Q9UBY5 6/20 0.42
LPAR2 Q9HBW0 2/20 0.42
NTRK1 P04629 1/20 0.37
ENPP2 Q13822 1/20 0.36

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
SCHEMBL15013193 1.00 LPAR1 (0.54) LPAR1LPAR3LPAR2NTRK1ENPP2
SCHEMBL14710563 0.88 LPAR1 (0.57) LPAR1LPAR3LPAR2NTRK1
SCHEMBL15013215 0.88 LPAR1 (0.56) LPAR1LPAR3LPAR2NTRK1
SCHEMBL15013213 0.88 LPAR1 (0.56) LPAR1LPAR3LPAR2NTRK1
SCHEMBL16211066 0.86 LPAR1 (0.53) LPAR1LPAR3NTRK1
SCHEMBL16211067 0.86 LPAR1 (0.53) LPAR1LPAR3NTRK1
SCHEMBL15013339 0.85 LPAR1 (0.59) LPAR1LPAR3LPAR2
SCHEMBL14790532 0.85 LPAR1 (0.52) LPAR1LPAR3LPAR2ENPP2
SCHEMBL15013337 0.85 LPAR1 (0.59) LPAR1LPAR3LPAR2
SCHEMBL14790534 0.84 LPAR1 (0.51) LPAR1LPAR3LPAR2

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-20140329871-A1 SMALL MOLECULE ANTI-FIBROTIC COMPOUNDS AND USES THEREOF ANGION BIOMEDICA CORP. (US) 2014-11-06 US claimed
US-20140329871-A1 SMALL MOLECULE ANTI-FIBROTIC COMPOUNDS AND USES THEREOF ANGION BIOMEDICA CORP. (US) 2014-11-06 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-20140329871-A1 SMALL MOLECULE ANTI-FIBROTIC COMPOUNDS AND USES THEREOF MMP1, COL1A1, COL2A1 LPAR1 709/4885LPAR3 699/4885LPAR2 530/4885

“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.