SCHEMBL30463796

SCHEMBL30463796

CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)c2ccccc2Nc2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.51
▸ RXFP1 Q9HBX9 5/20 0.50
▸ PTPN2 P17706 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ PTPN6 P29350 1/20 0.45
▸ TGFBR1 P36897 1/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ RIN1 Q13671 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ STS P08842 1/20 0.44
▸ TACR1 P25103 1/20 0.43
▸ NR3C1 P04150 1/20 0.43
▸ P2RY14 Q15391 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ PARP1 P09874 1/20 0.42
▸ PARP2 Q9UGN5 1/20 0.42
▸ JAK2 O60674 1/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ PTK2 Q05397 1/20 0.41

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
SCHEMBL23701602 0.87 RXFP1 (0.53) RXFP1
SCHEMBL22556320 0.87 RXFP1 (0.53) RXFP1
SCHEMBL22556375 0.82 MEN1 (0.55) KMT2ARXFP1MAPTJAK2
SCHEMBL30463745 0.82 MEN1 (0.55) KMT2ARXFP1MAPTJAK2
SCHEMBL27157329 0.78 KMT2A (0.48) KMT2AABL1RIN1MAPTKDM4E
SCHEMBL27157338 0.76 KMT2A (0.50) KMT2AABL1RIN1MAPTKDM4E
SCHEMBL23411576 0.75 KMT2A (0.68) KMT2APTPN2PTPN1PTPN6ABL1
SCHEMBL27157319 0.75 KMT2A (0.47) KMT2AABL1RIN1MAPTKDM4E
SCHEMBL29716354 0.74 PTPN2 (0.77) KMT2APTPN2PTPN1PTPN6TGFBR1
SCHEMBL25362245 0.74 PTPN2 (0.54) KMT2APTPN2PTPN1PTPN6ABL1

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-11661403-B2 Oxadiazole compounds VIVACE THERAPEUTICS, INC. (US) 2023-05-30 — — 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-11661403-B2 Oxadiazole compounds YAP1, TEAD2, TEAD3 KMT2A 2329/4885RXFP1 3511/4885PTPN2 1857/4885

“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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