SCHEMBL21765032

SCHEMBL21765032

COC(=O)c1ccccc1Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.69
ALOX15 P16050 1/20 0.69
SIRT2 Q8IXJ6 1/20 0.56
KDM4E B2RXH2 1/20 0.53
POLB P06746 1/20 0.53
ATM Q13315 1/20 0.53
TAS2R14 Q9NYV8 5/20 0.51
RXFP1 Q9HBX9 3/20 0.51
AKR1C3 P42330 1/20 0.51
AKR1C2 P52895 1/20 0.51
MAPK8 P45983 1/20 0.50
KMT2A Q03164 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2D6 P10635 1/20 0.49
TSHR P16473 1/20 0.49
MEN1 O00255 1/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 1/20 0.49
CFTR P13569 1/20 0.49

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
SCHEMBL13224505 0.87 MAPT (0.89) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL22556586 0.86 CDC25B (0.56) MAPTALOX15KDM4ETAS2R14CYP1A2
SCHEMBL25279533 0.85 AKR1C3 (0.60) MAPTSIRT2TAS2R14RXFP1AKR1C3
SCHEMBL9271694 0.85 RXFP1 (0.70) MAPTALOX15TAS2R14RXFP1AKR1C3
SCHEMBL22853361 0.83 MAPT (0.76) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL4245559 0.83 MAPK8 (0.67) MAPTTAS2R14RXFP1AKR1C3AKR1C2
SCHEMBL12109319 0.83 MAPT (0.81) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL22453592 0.83 MRGPRX4 (0.53) MAPTALOX15KDM4EATMRXFP1
SCHEMBL31914 0.82 MAPT (1.00) MAPTALOX15SIRT2KDM4EPOLB
SCHEMBL28322767 0.82 TSHR (0.56) MAPTALOX15SIRT2KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116761795-A Inhibitors of Transcription Enhancement Associated Domain (TEAD) and uses thereof 达纳-法伯癌症研究所股份有限公司 2023-09-15 CN disclosed
US-11661403-B2 Oxadiazole compounds VIVACE THERAPEUTICS, INC. (US) 2023-05-30 US disclosed
US-11661403-B2 Oxadiazole compounds VIVACE THERAPEUTICS, INC. (US) 2023-05-30 US disclosed
US-11661403-B2 Oxadiazole compounds VIVACE THERAPEUTICS, INC. (US) 2023-05-30 US disclosed
US-11186554-B2 Non-fused tricyclic compounds VIVACE THERAPEUTICS, INC. (US) 2021-11-30 US disclosed
US-20210238154-A1 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. 2021-08-05 US disclosed
US-20210238154-A1 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. 2021-08-05 US disclosed
EP-3793551-A1 OXADIAZOLE COMPOUNDS Vivace Therapeutics, Inc. (US) 2021-03-24 EP disclosed
WO-2019222431-A9 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2020-10-22 WO disclosed
WO-2019222431-A9 OXADIAZOLE COMPOUNDS VIVACE THERAPEUTICS, INC. (US) 2020-10-22 WO disclosed
US-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2020-02-27 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 (4 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-20200062721-A1 NON-FUSED TRICYCLIC COMPOUNDS YAP1, MYC, TEAD2 MAPT 1705/4885ALOX15 3003/4885SIRT2 1545/4885
US-11186554-B2 Non-fused tricyclic compounds YAP1, MYC, TEAD2 MAPT 1705/4885ALOX15 3003/4885SIRT2 1545/4885
US-20210238154-A1 OXADIAZOLE COMPOUNDS YAP1, TEAD2, TEAD3 MAPT 2455/4885ALOX15 2404/4885SIRT2 1044/4885
US-11661403-B2 Oxadiazole compounds YAP1, TEAD2, TEAD3 MAPT 2455/4885ALOX15 2404/4885SIRT2 1044/4885

“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.