SCHEMBL20535840

SCHEMBL20535840

Clc1cccc(Oc2cccc3[nH]ccc23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 13/20 1.00
TRPA1 O75762 1/20 0.52
SLC6A4 P31645 3/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A3 Q01959 2/20 0.45
HTR1A P08908 1/20 0.45
HTR2A P28223 1/20 0.44
KCNH2 Q12809 1/20 0.44
TTBK1 Q5TCY1 1/20 0.44

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
SCHEMBL20536271 0.86 RHEB (1.00) RHEBSLC6A4HTR2AKCNH2TTBK1
SCHEMBL9047954 0.84 RHEB (0.72) RHEBTRPA1SLC6A4HTR2A
SCHEMBL4716647 0.82 RHEB (0.69) RHEBTRPA1
SCHEMBL20536163 0.81 RHEB (0.68) RHEBTRPA1SLC6A4SLC6A2SLC6A3
SCHEMBL20536492 0.80 RHEB (1.00) RHEBTRPA1
SCHEMBL20535781 0.80 RHEB (1.00) RHEBTRPA1SLC6A4SLC6A2SLC6A3
SCHEMBL1499400 0.79 RHEB (0.73) RHEBTRPA1SLC6A3HTR1A
SCHEMBL24196246 0.78 RHEB (0.63) RHEBTRPA1SLC6A3HTR1A
SCHEMBL23709718 0.76 RHEB (0.79) RHEBTRPA1SLC6A4SLC6A2SLC6A3
SCHEMBL23709518 0.76 RHEB (0.73) RHEBTRPA1SLC6A2HTR1A

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 RHEB 1/4885TRPA1 4835/4885SLC6A4 4819/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS RHEB 1/4885TRPA1 4877/4885SLC6A4 4806/4885

“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.