SCHEMBL25056302

SCHEMBL25056302

COc1cc2c(cc1N)-c1cnn(C)c1COC2

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 2/20 0.35
▸ ACVR1 Q04771 2/20 0.35
▸ CYP3A4 P08684 1/20 0.33
▸ S100B P04271 1/20 0.33
▸ PLK1 P53350 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33
▸ PLK3 Q9H4B4 1/20 0.33
▸ CYP11B1 P15538 1/20 0.31
▸ CYP11B2 P19099 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ GAA P10253 1/20 0.30

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
SCHEMBL25056305 0.83 PLK1 (0.46) CYP3A4S100BPLK1CSNK2A1PLK3
SCHEMBL25056360 0.81 MAOA (0.37) TGFBR1ACVR1S100BPLK1CSNK2A1
SCHEMBL25637771 0.80 SIRT6 (0.39) TGFBR1ACVR1PKM
SCHEMBL25056298 0.79 CYP11B1 (0.33) CYP3A4S100BCYP11B1CYP11B2POLB
SCHEMBL25056352 0.73 PLK1 (0.35) TGFBR1ACVR1S100BPLK1CSNK2A1
SCHEMBL25056148 0.72 CYP11B1 (0.36) CYP3A4S100BPLK1CSNK2A1PLK3
SCHEMBL25056306 0.72 PLK1 (0.48) S100BPLK1CSNK2A1PLK3CYP11B1
SCHEMBL25056313 0.72 PLK1 (0.35) S100BPLK1CSNK2A1PLK3CYP11B1
SCHEMBL25056250 0.71 MEN1 (0.38) S100BPLK1CSNK2A1PLK3CYP11B1
SCHEMBL25637784 0.69 KDM4E (0.46) CYP3A4POLBGAA

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-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO LTD (CN) 2023-06-22 — — US disclosed
US-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO LTD (CN) 2023-06-22 — — US disclosed
EP-4137484-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS QILU PHARMACEUTICAL CO., LTD. (CN) 2023-02-22 — — EP 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-20230192734-A1 TRICYCLIC COMPOUNDS AS EGFR INHIBITORS EGFR, ERBB2, ERBB3 TGFBR1 1030/4885ACVR1 734/4885CYP3A4 3056/4885

“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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