SCHEMBL25786602

SCHEMBL25786602

CC(C)(F)c1ccc(Nc2ccccc2-c2nnn(Cc3cccnc3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HIF1A Q16665 1/20 0.38
▸ EPAS1 Q99814 1/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ CCR9 P51686 1/20 0.36
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2B Q13224 1/20 0.36
▸ PLK1 P53350 2/20 0.36
▸ P2RX7 Q99572 3/20 0.36
▸ MAPT P10636 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NR3C1 P04150 1/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.35
▸ ABL1 P00519 2/20 0.35
▸ BCR P11274 2/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MEN1 O00255 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
SCHEMBL25787692 0.93 CYP3A4 (0.39) CYP3A4CYP2C19HIF1AEPAS1RAB9A
SCHEMBL21749247 0.92 HIF1A (0.45) CYP3A4CYP2C19HIF1AEPAS1RAB9A
SCHEMBL25787689 0.90 HIF1A (0.38) CYP3A4CYP2C19HIF1AEPAS1RAB9A
SCHEMBL25786607 0.89 HDAC6 (0.41) CYP3A4CYP2C19RAB9AL3MBTL1MAPT
SCHEMBL21749265 0.86 ABL1 (0.50) CYP3A4CYP2C19RAB9AL3MBTL1MAPT
SCHEMBL21749297 0.82 HDAC6 (0.47) HIF1AEPAS1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL25786687 0.77 SMN1; SMN2 (0.47) CYP3A4CYP2C19RAB9AL3MBTL1MAPT
SCHEMBL25787803 0.77 USP2 (0.46) CYP3A4CYP2C19L3MBTL1MAPTSMN1; SMN2
SCHEMBL21749248 0.76 USP2 (0.48) CYP3A4CYP2C19RAB9AL3MBTL1PLK1
SCHEMBL21749272 0.74 FLT1 (0.47) RAB9AL3MBTL1MAPTSMN1; SMN2ABL1

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 CYP3A4 1995/4885CYP2C19 4704/4885HIF1A 971/4885

“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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