SCHEMBL22719735

SCHEMBL22719735

CON(C)C(=O)c1cc(Br)ccc1Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 4/20 0.68
▸ AKR1C3 P42330 2/20 0.51
▸ AKR1C2 P52895 2/20 0.51
▸ RXFP1 Q9HBX9 5/20 0.49
▸ GRIK1 P39086 1/20 0.47
▸ YAP1 P46937 1/20 0.47
▸ TEAD4 Q15561 1/20 0.47
▸ TEAD2 Q15562 1/20 0.47
▸ TP53 P04637 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ TAS2R14 Q9NYV8 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL29504944 1.00 MPO (0.68) MPOAKR1C3AKR1C2RXFP1GRIK1
SCHEMBL22719560 0.83 MPO (0.79) MPOAKR1C3AKR1C2RXFP1GRIK1
SCHEMBL29504999 0.83 MPO (0.79) MPOAKR1C3AKR1C2RXFP1GRIK1
SCHEMBL29438860 0.83 MAPT (0.51) MPOAKR1C3AKR1C2RXFP1YAP1
SCHEMBL22718119 0.83 MAPT (0.51) MPOAKR1C3AKR1C2RXFP1YAP1
SCHEMBL1688342 0.81 MPO (1.00) MPOAKR1C3AKR1C2RXFP1GRIK1
SCHEMBL22719694 0.78 RAPGEF4 (0.51) AKR1C3AKR1C2RXFP1YAP1TEAD4
SCHEMBL29505051 0.78 RAPGEF4 (0.51) AKR1C3AKR1C2RXFP1YAP1TEAD4
SCHEMBL29504977 0.77 MPO (0.74) MPOAKR1C3AKR1C2RXFP1GRIK1
SCHEMBL22719595 0.77 MPO (0.74) MPOAKR1C3AKR1C2RXFP1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11925651-B2 TEAD inhibitors and uses thereof Ikena Oncology, Inc. (US) 2024-03-12 — — US disclosed
US-20230148061-A1 TEAD INHIBITORS AND USES THEREOF THE EHE FOUNDATION 2023-05-11 — — US disclosed
US-20230148061-A1 TEAD INHIBITORS AND USES THEREOF THE EHE FOUNDATION 2023-05-11 — — US disclosed
US-20230148061-A1 TEAD INHIBITORS AND USES THEREOF THE EHE FOUNDATION 2023-05-11 — — US disclosed
US-11458149-B1 TEAD inhibitors and uses thereof Ikena Oncology, Inc. (US) 2022-10-04 — — US disclosed
EP-3976192-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2022-04-06 — — EP disclosed
WO-2020243423-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2020-12-03 — — WO disclosed
WO-2020243423-A1 TEAD INHIBITORS AND USES THEREOF Ikena Oncology, Inc. (US) 2020-12-03 — — 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 (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-20230148061-A1 TEAD INHIBITORS AND USES THEREOF TEAD2, TEAD3, TEAD4 MPO 641/4885AKR1C3 2451/4885AKR1C2 2578/4885
US-11925651-B2 TEAD inhibitors and uses thereof TEAD2, TEAD3, TEAD4 MPO 641/4885AKR1C3 2451/4885AKR1C2 2578/4885
US-11458149-B1 TEAD inhibitors and uses thereof TEAD2, TEAD3, TEAD4 MPO 641/4885AKR1C3 2451/4885AKR1C2 2578/4885

“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.

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