SCHEMBL20535781

SCHEMBL20535781

Clc1ccc(Oc2cccc3[nH]ccc23)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 11/20 1.00
TRPA1 O75762 1/20 0.58
SLC6A2 P23975 3/20 0.47
SLC6A3 Q01959 3/20 0.47
SLC6A4 P31645 2/20 0.47
NR1I2 O75469 1/20 0.46
LMNA P02545 1/20 0.46
TTR P02766 1/20 0.46
PGR P06401 1/20 0.46
HSP90AA1 P07900 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
MAPT P10636 1/20 0.46
HSPA5 P11021 1/20 0.46
HPGD P15428 1/20 0.46
CBR1 P16152 1/20 0.46
TBXA2R P21731 1/20 0.46
AGTR1 P30556 1/20 0.46
SCN9A Q15858 1/20 0.46
EGFR P00533 1/20 0.45
ERBB2 P04626 1/20 0.45

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
SCHEMBL20536492 0.88 RHEB (1.00) RHEBTRPA1SCN9AEGFRERBB2
SCHEMBL3484703 0.85 RHEB (0.74) RHEBTRPA1MAPTSCN9AEGFR
SCHEMBL23709718 0.84 RHEB (0.79) RHEBTRPA1SLC6A2SLC6A3SLC6A4
SCHEMBL1499400 0.82 RHEB (0.73) RHEBTRPA1SLC6A3LMNAMAPT
SCHEMBL20535840 0.80 RHEB (1.00) RHEBTRPA1SLC6A2SLC6A3SLC6A4
SCHEMBL3483984 0.80 RHEB (0.66) RHEBTRPA1LMNAMAPTHPGD
SCHEMBL9047954 0.80 RHEB (0.72) RHEBTRPA1SLC6A4MAPTMEN1
SCHEMBL20536085 0.80 RHEB (1.00) RHEBTRPA1SLC6A2SLC6A3SLC6A4
SCHEMBL16632580 0.78 RHEB (0.63) RHEBTRPA1SLC6A4
SCHEMBL23709518 0.78 RHEB (0.73) RHEBTRPA1SLC6A2MAPTSCN9A

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 4835/4885SLC6A2 4669/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS RHEB 1/4885TRPA1 4877/4885SLC6A2 4732/4885

“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.