SCHEMBL16913005

SCHEMBL16913005

CC(C)(C)C1CCN(S(=O)(=O)c2ccc(N)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TDP1 Q9NUW8 1/20 0.51
MCOLN3 Q8TDD5 1/20 0.50
DDIT3 P35638 1/20 0.49
PKM P14618 3/20 0.49
LMNA P02545 2/20 0.49
HSD11B1 P28845 2/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GAA P10253 2/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL12201514 0.84 LMNA (0.69) MEN1KMT2ATDP1PKMLMNA
SCHEMBL26363871 0.84 LMNA (0.67) MEN1KMT2ATDP1LMNAHSD11B1
SCHEMBL17069876 0.84 POLB (0.57) MEN1KMT2ATDP1PKMLMNA
SCHEMBL4212319 0.82 MEN1 (0.75) MEN1KMT2ATDP1MCOLN3LMNA
SCHEMBL17069864 0.82 GAA (0.62) MEN1KMT2ATDP1PKMHSD11B1
SCHEMBL16197203 0.81 KMT2A (0.60) MEN1KMT2ADDIT3LMNAMAPT
SCHEMBL16912989 0.81 SMN1; SMN2 (0.62) DDIT3LMNAHSD11B1SMN1; SMN2
SCHEMBL29333973 0.81 ALDH1A1 (0.62) MEN1KMT2ATDP1PKMLMNA
SCHEMBL16912992 0.80 MEN1 (0.61) MEN1KMT2ATDP1MCOLN3PKM
SCHEMBL14095893 0.80 MEN1 (0.61) MEN1KMT2ATDP1MCOLN3PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10787439-B2 Compounds and methods for activating the apoptotic arm of the unfolded protein response UNIVERSITY OF KANSAS (US) 2020-09-29 US disclosed
US-10787439-B2 Compounds and methods for activating the apoptotic arm of the unfolded protein response UNIVERSITY OF KANSAS (US) 2020-09-29 US disclosed
US-20170334889-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE UNIVERSITY OF KANSAS 2017-11-23 US disclosed
US-20170334889-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE UNIVERSITY OF KANSAS 2017-11-23 US disclosed
US-20170334889-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE UNIVERSITY OF KANSAS 2017-11-23 US disclosed
US-9732067-B2 Compounds and methods for activating the apoptotic arm of the unfolded protein response UNIVERSITY OF KANSAS (US) 2017-08-15 US disclosed
US-9732067-B2 Compounds and methods for activating the apoptotic arm of the unfolded protein response UNIVERSITY OF KANSAS (US) 2017-08-15 US disclosed
US-9732067-B2 Compounds and methods for activating the apoptotic arm of the unfolded protein response UNIVERSITY OF KANSAS (US) 2017-08-15 US disclosed
US-20150203477-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-07-23 US disclosed
US-20150203477-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-07-23 US disclosed
US-20150203477-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-07-23 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-20150203477-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE IAPP, TFEB, GBA1 MEN1 4149/4885KMT2A 3270/4885TDP1 1506/4885
US-10787439-B2 Compounds and methods for activating the apoptotic arm of the unfolded protein response IAPP, TFEB, GBA1 MEN1 4149/4885KMT2A 3270/4885TDP1 1506/4885
US-20170334889-A1 COMPOUNDS AND METHODS FOR ACTIVATING THE APOPTOTIC ARM OF THE UNFOLDED PROTEIN RESPONSE IAPP, TFEB, GBA1 MEN1 4149/4885KMT2A 3270/4885TDP1 1506/4885

“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.