SCHEMBL20535567

SCHEMBL20535567

CC(C)(C)OC(=O)CNc1cc(Cl)c(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.44
MAPT P10636 5/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
MAPK1 P28482 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KMT2A Q03164 3/20 0.38
PKM P14618 2/20 0.38
MEN1 O00255 2/20 0.38
BCL6 P41182 1/20 0.38
BCOR Q6W2J9 1/20 0.38
ALDH1A1 P00352 4/20 0.38
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL25139738 0.85 ALDH1A1 (0.53) LMNAMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL21501953 0.81 LMNA (0.52) LMNAMAPTMAPK1L3MBTL1KMT2A
SCHEMBL26830787 0.81 MAPT (0.56) LMNAMAPTHTTMAPK1L3MBTL1
SCHEMBL5562912 0.80 NPC1 (0.41) LMNAMAPTCYP1A2CYP3A4CYP2D6
SCHEMBL30288984 0.80 LMNA (0.43) LMNAMAPTMAPK1L3MBTL1KMT2A
SCHEMBL18174193 0.80 LMNA (0.51) LMNAMAPTMAPK1L3MBTL1KMT2A
SCHEMBL8192345 0.79 LMNA (0.41) LMNAMAPTHTTNPSR1MAPK1
SCHEMBL8194643 0.79 MEN1 (0.42) LMNACYP3A4MAPK1KMT2APKM
SCHEMBL28848976 0.79 LMNA (0.42) LMNAMAPTMAPK1L3MBTL1KMT2A
SCHEMBL4314450 0.79 SMN1; SMN2 (0.53) LMNAMAPTHTTMAPK1KMT2A

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-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2022-05-24 US disclosed
US-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2021-08-05 US disclosed
WO-2018191146-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-10-18 WO 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-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF RHEB, KRAS, NRAS LMNA 4243/4885MAPT 4119/4885CYP1A2 3007/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS LMNA 2918/4885MAPT 2840/4885CYP1A2 2405/4885

“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.