SCHEMBL18681244

SCHEMBL18681244

CC(C)(C)C(=O)NCC(=O)N1CC[C@H](O)[C@H]1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 4/20 0.51
▸ PREP P48147 3/20 0.51
▸ DPP4 P27487 8/20 0.39
▸ PIK3CA P42336 2/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ SIRT2 Q8IXJ6 7/20 0.32
▸ SIRT1 Q96EB6 7/20 0.32
▸ SIRT3 Q9NTG7 7/20 0.32
▸ DPP8 Q6V1X1 2/20 0.32
▸ DPP9 Q86TI2 2/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2D6 P10635 1/20 0.31
▸ DPP7 Q9UHL4 1/20 0.31

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
SCHEMBL18675245 0.86 FAP (0.51) FAPPREPDPP4PIK3CAPIK3CB
SCHEMBL17282585 0.84 FAP (0.48) FAPPREPDPP4PIK3CAPIK3CB
SCHEMBL18681161 0.76 FAP (0.63) FAPPREPDPP4DPP8DPP9
SCHEMBL18681073 0.75 PIK3CA (0.37) FAPPREPDPP4PIK3CAPIK3CB
SCHEMBL883054 0.70 MEN1 (0.48) FAPPREPPIK3CAPIK3CBPIK3CD
SCHEMBL11770755 0.70 PIK3CA (0.37) PIK3CAPIK3CBPIK3CDPIK3CG
SCHEMBL15756632 0.70 PREP (0.34) FAPPREPDPP4DPP8DPP9
SCHEMBL18771284 0.70 PIK3CA (0.36) FAPPREPDPP4PIK3CAPIK3CB
SCHEMBL5206653 0.69 CHRM2 (0.41) PREPPIK3CAPIK3CB
SCHEMBL8244090 0.68 FAP (1.00) FAPPREPDPP4DPP8DPP9

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-10392422-B2 Macrocyclic broad spectrum antibiotics RQX PHARMACEUTICALS, INC. (US) 2019-08-27 — — US disclosed
US-10351595-B2 — — 2019-07-16 — — US disclosed
US-20170088582-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS, INC. (US) 2017-03-30 — — 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 (3 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-10351595-B2 — MRPL21, PRSS1, PEPD FAP 109/4885PREP 10/4885DPP4 75/4885
US-10392422-B2 Macrocyclic broad spectrum antibiotics MRPL21, PEPD, CTSC FAP 206/4885PREP 16/4885DPP4 58/4885
US-20170088582-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS MRPL21, PEPD, CTSC FAP 206/4885PREP 16/4885DPP4 58/4885

“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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