SCHEMBL4281029

SCHEMBL4281029

OC1Cc2ccccc2[C]C1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.35
ANPEP P15144 1/20 0.34
SLC18A3 Q16572 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9510934 0.76 ANPEP (0.39) ANPEPSLC18A3
SCHEMBL4518955 0.74 PNMT (0.39) PNMT
SCHEMBL4407901 0.71 ANPEP (0.33) ANPEPMEN1KMT2A
SCHEMBL6962983 0.71 ANPEP (0.33) ANPEPMEN1KMT2A
SCHEMBL4513001 0.67 IDO1 (0.32) PNMT
SCHEMBL20063792 0.65 ANPEP (0.56) ANPEPSLC18A3
SCHEMBL1990443 0.65 ANPEP (0.56) ANPEPSLC18A3
SCHEMBL1990446 0.65 ANPEP (0.56) ANPEPSLC18A3
SCHEMBL29687690 0.65 ANPEP (0.56) ANPEPSLC18A3
SCHEMBL20095994 0.65 ANPEP (0.56) ANPEPSLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 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-20090137580-A1 Fused Heterocyclic Derivatives and Use Thereof TIE1, KDR, FLT1 PNMT 1875/4885ANPEP 815/4885SLC18A3 4479/4885

“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.