SCHEMBL20676201

SCHEMBL20676201

CC(C)(C)OC(=O)N1CCN(C(=O)Cn2ccc3cc(Br)ccc32)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 7/20 0.47
▸ LOXL2 Q9Y4K0 1/20 0.47
▸ DTYMK P23919 2/20 0.44
▸ NTSR1 P30989 1/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ CHRM4 P08173 1/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ CHRM3 P20309 1/20 0.44
▸ USP30 Q70CQ3 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ BACE1 P56817 2/20 0.42
▸ IDO1 P14902 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ HTR7 P34969 1/20 0.41
▸ LMNA P02545 1/20 0.41

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
SCHEMBL19145537 0.87 LOXL2 (0.47) LOXL2DTYMKCHRM2CHRM4CHRM1
SCHEMBL17063253 0.83 FPR2 (0.48) KRASUSP30KDM4EBACE1
SCHEMBL19126497 0.81 LOXL2 (0.43) LOXL2DTYMKCHRM2CHRM4CHRM1
SCHEMBL29930198 0.81 IDO1 (0.53) KRASNTSR1IDO1HTR2AHTR2C
SCHEMBL23810852 0.81 NTSR1 (0.51) KRASNTSR1HTR2AHTR2CHTR7
SCHEMBL20604745 0.79 KMT2A (0.56) KRASNTSR1LMNA
SCHEMBL19126538 0.77 GPR119 (0.44) LOXL2
SCHEMBL1921265 0.77 MAPT (0.48) CHRM2CHRM4CHRM1CHRM3LMNA
SCHEMBL4898807 0.76 USP30 (0.50) USP30KDM4EBACE1
SCHEMBL6693325 0.76 BACE1 (0.45) BACE1

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-10669251-B2 Quinolin-2-one derivatives MERCK PATENT GMBH (DE) 2020-06-02 — — US disclosed
US-20190023685-A1 QUINOLIN-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2019-01-24 — — 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 (2 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-20190023685-A1 QUINOLIN-2-ONE DERIVATIVES KIT, CDK2, CDK1 KRAS 272/4885LOXL2 3240/4885DTYMK 588/4885
US-10669251-B2 Quinolin-2-one derivatives KIT, CDK2, CDK1 KRAS 272/4885LOXL2 3240/4885DTYMK 588/4885

“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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