SCHEMBL20535609

SCHEMBL20535609

Nc1cc(Cl)c(OCc2cccc(F)c2)cc1N

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.55
IDO1 P14902 2/20 0.51
AGXT P21549 2/20 0.51
EGFR P00533 5/20 0.49
ERBB2 P04626 5/20 0.49
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49
MRGPRX4 Q96LA9 2/20 0.49
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 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
SCHEMBL4270131 0.93 MAOB (0.54) MAOBIDO1AGXTEGFRERBB2
SCHEMBL30792249 0.91 MAOB (0.52) MAOBIDO1AGXTEGFRERBB2
SCHEMBL21835378 0.91 MAOB (0.52) MAOBIDO1AGXTEGFRERBB2
SCHEMBL20535332 0.84 MRGPRX4 (0.57) MAOBIDO1AGXTMRGPRX4
SCHEMBL29388015 0.84 MAOB (0.61) MAOBIDO1AGXTEGFRERBB2
SCHEMBL156718 0.84 MAOB (0.61) MAOBIDO1AGXTEGFRERBB2
SCHEMBL29514868 0.84 MAOB (0.61) MAOBIDO1AGXTEGFRERBB2
SCHEMBL20535585 0.83 MGMT (0.50) MAOBIDO1AGXTEGFRERBB2
SCHEMBL20536264 0.83 MAOB (0.49) MAOBIDO1AGXTLMNA
Hydrochloric Acid SCHEMBL216004 0.82 MAOB (0.62) MAOBIDO1AGXTEGFRERBB2

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-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2022-05-24 US disclosed
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
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 MAOB 491/4885IDO1 2311/4885AGXT 3767/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS MAOB 1112/4885IDO1 3778/4885AGXT 2551/4885

“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.