SCHEMBL25786802

SCHEMBL25786802

CCOC(=O)Cn1nc(C)c(-c2ccccc2Nc2cccc(C(F)(F)P)c2)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.41
▸ LMNA P02545 4/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ATM Q13315 1/20 0.39
▸ RECQL P46063 1/20 0.38
▸ CACNA1B Q00975 1/20 0.37
▸ APBA1 Q02410 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ GRIN1 Q05586 2/20 0.36
▸ GRIN2B Q13224 2/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ TRPV4 Q9HBA0 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ YAP1 P46937 1/20 0.36
▸ TEAD4 Q15561 1/20 0.36
▸ TEAD2 Q15562 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35

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
SCHEMBL20553072 0.93 LMNA (0.45) LMNAKMT2ARECQLCACNA1BAPBA1
SCHEMBL25786834 0.86 KCNK18 (0.38) LMNAKMT2ARECQLMEN1YAP1
SCHEMBL20552924 0.84 KMT2A (0.43) HTTLMNAKMT2ANPSR1NPC1
SCHEMBL25786811 0.83 KCNK18 (0.35) LMNARECQLNPSR1NPC1YAP1
SCHEMBL20553004 0.82 LMNA (0.48) LMNARECQLNPSR1YAP1TEAD4
SCHEMBL25786817 0.81 LMNA (0.47) LMNAKMT2ARECQLNPSR1MEN1
SCHEMBL20553653 0.78 YAP1 (0.46) LMNAKMT2AATMRECQLCACNA1B
SCHEMBL21749293 0.76 CACNA1B (0.44) HTTLMNARECQLCACNA1BAPBA1
SCHEMBL21749237 0.76 ALDH1A1 (0.44) LMNARECQLYAP1TEAD4TEAD2
SCHEMBL25786325 0.75 XPO1 (0.46) LMNAKMT2ANPSR1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 — — 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 (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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 HTT 1935/4885LMNA 2451/4885KMT2A 1804/4885

“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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