SCHEMBL18699677

SCHEMBL18699677

O=C1[C@H](Cc2ccccc2)N2C(=O)CCN(C(=O)NCc3ccccc3)C2CN1Cc1cccc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CLPP Q16740 19/20 1.00
CTNNB1 P35222 2/20 0.92
TCF7 P36402 2/20 0.92
BCL9 O00512 1/20 0.92
TCF4 P15884 1/20 0.92
CREBBP Q92793 1/20 0.92

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
SCHEMBL15677334 1.00 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL15677335 0.96 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL20752946 0.96 CLPP (0.92) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL178745 0.96 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL19833048 0.96 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL4865597 0.96 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL19833044 0.96 CLPP (0.92) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL13744871 0.96 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL29352986 0.96 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4
SCHEMBL4865605 0.96 CLPP (1.00) CLPPCTNNB1TCF7BCL9TCF4

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-11213527-B2 Inhibitory effect of low molecular weight compound on cancer and fibrosis NATIONAL UNIVERSITY CORPORATION TOTTORI UNIVERSITY (JP) 2022-01-04 US disclosed
US-20210386747-A1 INHIBITORY EFFECT OF LOW MOLECULAR WEIGHT COMPOUND ON CANCER AND FIBROSIS KANONCURE, INC. (JP) 2021-12-16 US disclosed
EP-3150207-A1 INHIBITORY EFFECT OF LOW MOLECULAR WEIGHT COMPOUND ON CANCER AND FIBROSIS National University Corporation Tottori University (JP) 2017-04-05 EP 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 (2 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-11213527-B2 Inhibitory effect of low molecular weight compound on cancer and fibrosis MMP1, SERPINB1, LGALS1 CLPP 4247/4885CTNNB1 481/4885TCF7 673/4885
US-20210386747-A1 INHIBITORY EFFECT OF LOW MOLECULAR WEIGHT COMPOUND ON CANCER AND FIBROSIS MMP1, SERPINB1, LGALS1 CLPP 4247/4885CTNNB1 481/4885TCF7 673/4885

“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.