SCHEMBL20063792

SCHEMBL20063792

O[C@H]1Cc2ccccc2C[C@@H]1O

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.56
SLC18A3 Q16572 3/20 0.47
IDO1 P14902 2/20 0.46
SIGMAR1 Q99720 1/20 0.43
PLAU P00749 1/20 0.42

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
SCHEMBL29687690 1.00 ANPEP (0.56) ANPEPSLC18A3IDO1SIGMAR1PLAU
SCHEMBL20095994 1.00 ANPEP (0.56) ANPEPSLC18A3IDO1SIGMAR1PLAU
SCHEMBL1990446 1.00 ANPEP (0.56) ANPEPSLC18A3IDO1SIGMAR1PLAU
SCHEMBL1990443 1.00 ANPEP (0.56) ANPEPSLC18A3IDO1SIGMAR1PLAU
Naphthalene SCHEMBL8201172 0.92 ANPEP (0.50) ANPEPSLC18A3IDO1SIGMAR1
SCHEMBL6932695 0.82 ANPEP (0.47) ANPEPSLC18A3IDO1SIGMAR1
SCHEMBL11355392 0.82 ANPEP (0.68) ANPEPSLC18A3IDO1PLAU
SCHEMBL22893170 0.82 ANPEP (0.47) ANPEPSLC18A3IDO1SIGMAR1
SCHEMBL3996873 0.82 ANPEP (0.68) ANPEPSLC18A3IDO1PLAU
SCHEMBL9515317 0.82 ANPEP (0.68) ANPEPSLC18A3IDO1PLAU

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-20200115354-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-04-16 US disclosed
US-10457654-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2019-10-29 US disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 US disclosed
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-04-19 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 (3 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-20200115354-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 ANPEP 1983/4885SLC18A3 2528/4885IDO1 2327/4885
US-10457654-B2 Therapeutic compounds and methods of use thereof NPY5R, REN, F12 ANPEP 1983/4885SLC18A3 2528/4885IDO1 2327/4885
US-20180105504-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF NPY5R, REN, F12 ANPEP 1906/4885SLC18A3 2402/4885IDO1 2338/4885

“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.