SCHEMBL23157299

SCHEMBL23157299

Nc1ncnc2c1c(-c1cc3cc(O)ccc3[nH]1)nn2CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 10/20 0.49
▸ MTOR P42345 8/20 0.49
▸ KDR P35968 6/20 0.49
▸ PIK3CD O00329 2/20 0.49
▸ BMPR1B O00238 1/20 0.49
▸ PLK4 O00444 1/20 0.49
▸ PIK3C2B O00750 1/20 0.49
▸ CASK O14936 1/20 0.49
▸ GAK O14976 1/20 0.49
▸ EPHB6 O15197 1/20 0.49
▸ DAPK3 O43293 1/20 0.49
▸ MAP3K7 O43318 1/20 0.49
▸ RIPK2 O43353 1/20 0.49
▸ PIP5K1C O60331 1/20 0.49
▸ JAK2 O60674 1/20 0.49
▸ BRD4 O60885 1/20 0.49
▸ RPS6KA5 O75582 1/20 0.49
▸ RPS6KA4 O75676 1/20 0.49
▸ STK16 O75716 1/20 0.49
▸ PIK3C2G O75747 1/20 0.49

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
SCHEMBL23251960 0.94 RET (0.49) RETMTORKDRPIK3CDBMPR1B
SCHEMBL23251525 0.94 RET (0.50) RETMTORKDRPIK3CDBMPR1B
SCHEMBL23251753 0.94 RET (0.50) RETMTORKDRPIK3CDBMPR1B
SCHEMBL25064484 0.92 RET (0.49) RETMTORKDRPIK3CDBMPR1B
SCHEMBL24519415 0.92 RET (0.51) RETMTORKDRPIK3CDBMPR1B
SCHEMBL19299725 0.92 RET (0.54) RETMTORKDRPIK3CDBMPR1B
SCHEMBL23157979 0.92 MTOR (0.46) RETMTORKDRPIK3CDBMPR1B
SCHEMBL19283054 0.90 MTOR (0.45) RETMTORKDRPIK3CDBMPR1B
SCHEMBL23158218 0.90 MTOR (0.45) RETMTORKDRPIK3CDBMPR1B
SCHEMBL23157933 0.90 MTOR (0.45) RETMTORKDRPIK3CDBMPR1B

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-20210094975-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS Revolution Medicines, Inc. 2021-04-01 — — 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-20210094975-A1 RAPAMYCIN ANALOGS AS MTOR INHIBITORS MTOR, RICTOR, RPTOR RET 1560/4885MTOR 1/4885KDR 2961/4885

“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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