SCHEMBL27089259

SCHEMBL27089259

COc1ccc(CN(Cc2ccc(OC)cc2)c2cncc(C(C)NCCO)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 1/20 0.40
▸ HTT P42858 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ PIK3CD O00329 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ MITF O75030 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA2B P29275 1/20 0.35
▸ QPCT Q16769 2/20 0.35
▸ PDE1B Q01064 1/20 0.35
▸ TSPO P30536 1/20 0.34
▸ ADRB2 P07550 4/20 0.34
▸ APLNR P35414 1/20 0.34

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
SCHEMBL29322620 0.74 APLNR (0.40) HTTSMN1; SMN2PIK3CDLMNAMAPT
SCHEMBL27088502 0.74 APLNR (0.40) HTTSMN1; SMN2PIK3CDLMNAMAPT
SCHEMBL29321909 0.74 LMNA (0.41) HTTSMN1; SMN2PIK3CDLMNAMAPT
SCHEMBL17440767 0.72 APLNR (0.43) LMNAMAPTALDH1A1KMT2AQPCT
SCHEMBL30897996 0.72 LMNA (0.44) HTTSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL27089390 0.72 LMNA (0.44) HTTSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL27089386 0.72 LMNA (0.44) HTTSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL17441334 0.72 ENPP2 (0.44) HTTSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL25861665 0.67 LMNA (0.46) PKMLMNAMAPTALDH1A1CYP11B1
SCHEMBL22878730 0.67 LMNA (0.51) LMNAMAPTALDH1A1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240383915-A1 OXAZEPINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF CANCER GENENTECH, INC. (US) 2024-11-21 — — US disclosed
EP-4320132-A1 OXAZEPINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF CANCER Genentech, Inc. (US) 2024-02-14 — — EP disclosed
WO-2022216762-A1 OXAZEPINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF CANCER GENENTECH, INC. (US) 2022-10-13 — — WO 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-20240383915-A1 OXAZEPINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF CANCER OXA1L, GRIK4, GRIK5 CASR 3044/4885HTT 3772/4885SMN1; SMN2 1620/4885

“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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