SCHEMBL3087762

SCHEMBL3087762

NOC1Cc2ccccc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 7/20 1.00
PLAU P00749 1/20 0.43
ANPEP P15144 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
FABP7 O15540 1/20 0.37
FABP5 Q01469 1/20 0.37
RET P07949 1/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL8230626 0.84 IDO1 (0.72) IDO1PLAUANPEPCA1CA2
SCHEMBL25385544 0.74 IDO1 (0.58) IDO1PLAUANPEPFABP7FABP5
SCHEMBL1944510 0.74 IDO1 (0.58) IDO1PLAU
SCHEMBL22050517 0.74 IDO1 (0.58) IDO1PLAUANPEPFABP7FABP5
SCHEMBL30275532 0.74 IDO1 (0.58) IDO1PLAU
SCHEMBL21937636 0.74 IDO1 (0.58) IDO1PLAUANPEPFABP7FABP5
SCHEMBL7255966 0.72 IDO1 (0.56) IDO1PLAU
SCHEMBL3187663 0.70 IDO1 (0.54) IDO1PLAUANPEPCA1CA2
SCHEMBL30685660 0.70 IDO1 (0.54) IDO1PLAUANPEPCA1CA2
SCHEMBL4024386 0.69 PLAU (0.54) IDO1PLAUANPEPCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100226875-A1 CONTROLLED RELEASE OF ACTIVE COMPOUNDS FROM DYNAMIC MIXTURES FIRMENICH SA (CH) 2010-09-09 US disclosed
EP-2010293-A2 CONTROLLED RELEASE OF ACTIVE COMPOUNDS FROM DYNAMIC MIXTURES Firmenich S.A. (CH) 2009-01-07 EP disclosed
WO-2007085991-A2 CONTROLLED RELEASE OF ACTIVE COMPOUNDS FROM DYNAMIC MIXTURES FIRMENICH SA (CH) 2007-08-02 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-20100226875-A1 CONTROLLED RELEASE OF ACTIVE COMPOUNDS FROM DYNAMIC MIXTURES HPD, TRHDE, BPHL IDO1 210/4885PLAU 3996/4885ANPEP 2448/4885

“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.