SCHEMBL21169302

SCHEMBL21169302

CC(C)C(=O)N1CCOC(c2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.54
MOGAT2 Q3SYC2 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
RIPK1 Q13546 1/20 0.42
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
CNR2 P34972 2/20 0.40
NAMPT P43490 1/20 0.40
DRD3 P35462 2/20 0.40
CHRM2 P08172 1/20 0.40
HTR1A P08908 1/20 0.40
HTR2B P41595 1/20 0.40
KDM1A O60341 1/20 0.39
PDE2A O00408 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
GSK3B P49841 1/20 0.38

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
SCHEMBL356037 0.84 USP30 (0.40) USP30NAMPTDRD3
SCHEMBL25453440 0.84 USP30 (0.54) USP30MOGAT2MEN1KMT2ARIPK1
SCHEMBL19049384 0.84 USP30 (0.54) USP30MOGAT2MEN1KMT2ARIPK1
SCHEMBL4730357 0.83 USP30 (0.55) USP30MOGAT2MEN1KMT2ARIPK1
SCHEMBL4730362 0.83 USP30 (0.55) USP30MOGAT2MEN1KMT2ARIPK1
SCHEMBL2133807 0.82 USP30 (0.51) USP30MOGAT2MEN1KMT2ACNR2
SCHEMBL14413642 0.82 USP30 (0.54) USP30MEN1KMT2ARIPK1CNR2
SCHEMBL20665224 0.81 KRAS (0.44) USP30MOGAT2PDE2A
SCHEMBL14035660 0.80 USP30 (0.51) USP30MEN1KMT2ARIPK1CNR2
SCHEMBL14413043 0.80 USP30 (0.59) USP30MOGAT2MEN1KMT2ACNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10933054-B2 Compounds that interact with the Ras superfamily for the treatment of cancers, inflammatory diseases, rasopathies, and fibrotic disease SHY Therapeutics LLC (US) 2021-03-02 US disclosed
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease SHY Therapeutics LLC (US) 2020-12-22 US disclosed
US-20200061037-A1 COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE SHY THERAPEUTICS, INC. 2020-02-27 US disclosed
US-20200054614-A1 COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE SHY THERAPEUTICS, INC. 2020-02-20 US disclosed
US-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE SHY Therapeutics LLC 2019-07-18 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 (5 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-20190218229-A1 COMPOUNDS FOR THE TREATMENT OF CANCER AND INFLAMMTORY DISEASE MAPK1, MAPK6, MAP3K1 USP30 1627/4885MOGAT2 2134/4885MEN1 3536/4885
US-10870657-B2 Compounds for the treatment of cancer and inflammatory disease MAPK6, MAP3K6, MAPK4 USP30 2123/4885MOGAT2 2563/4885MEN1 4080/4885
US-20200054614-A1 COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE HRAS, KRAS, NRAS USP30 1610/4885MOGAT2 3718/4885MEN1 1612/4885
US-10933054-B2 Compounds that interact with the Ras superfamily for the treatment of cancers, inflammatory diseases, rasopathies, and fibrotic disease HRAS, KRAS, NRAS USP30 1610/4885MOGAT2 3718/4885MEN1 1612/4885
US-20200061037-A1 COMPOUNDS THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE HRAS, KRAS, NRAS USP30 1610/4885MOGAT2 3718/4885MEN1 1612/4885

“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.