SCHEMBL29322620

SCHEMBL29322620

COc1ccc(CN(Cc2ccc(OC)cc2)c2ncc(F)cc2[C@@H](C)NCCO)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 3/20 0.40
▸ PIK3CD O00329 1/20 0.36
▸ HTT P42858 3/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MITF O75030 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PDCD1LG2 Q9BQ51 3/20 0.34
▸ CD274 Q9NZQ7 3/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ CCNE2 O96020 1/20 0.34
▸ CCNE1 P24864 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ ADRB3 P13945 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MMP2 P08253 1/20 0.33
▸ MMP9 P14780 1/20 0.33

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
SCHEMBL27088502 1.00 APLNR (0.40) APLNRPIK3CDHTTSMN1; SMN2MAPT
SCHEMBL31527599 0.85 APLNR (0.40) APLNRPIK3CDHTTMAPTLMNA
SCHEMBL27089390 0.82 LMNA (0.44) HTTSMN1; SMN2MAPTLMNAKMT2A
SCHEMBL30897996 0.82 LMNA (0.44) HTTSMN1; SMN2MAPTLMNAKMT2A
SCHEMBL27089386 0.82 LMNA (0.44) HTTSMN1; SMN2MAPTLMNAKMT2A
SCHEMBL30950051 0.79 CD274 (0.39) APLNRHTTSMN1; SMN2MAPTLMNA
SCHEMBL29321909 0.77 LMNA (0.41) APLNRPIK3CDHTTSMN1; SMN2MAPT
SCHEMBL27089259 0.74 CASR (0.40) APLNRPIK3CDHTTSMN1; SMN2MAPT
SCHEMBL30000304 0.74 APLNR (0.43) APLNRMAPTLMNAKMT2AALDH1A1
SCHEMBL27089082 0.74 APLNR (0.43) APLNRMAPTLMNAKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228512-A1 ACYCLIC OXAZEPINE COMPOUNDS COMPRISING A 6-AZA MOIETY AND USES THEREOF GENENTECH, INC. (US) 2024-07-11 — — US disclosed
US-20240228512-A1 ACYCLIC OXAZEPINE COMPOUNDS COMPRISING A 6-AZA MOIETY AND USES THEREOF GENENTECH, INC. (US) 2024-07-11 — — 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-20240228512-A1 ACYCLIC OXAZEPINE COMPOUNDS COMPRISING A 6-AZA MOIETY AND USES THEREOF AZI2, HDAC5, HDAC4 APLNR 681/4885PIK3CD 754/4885HTT 3949/4885

“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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