SCHEMBL20535365

SCHEMBL20535365

O=Cc1ccc(Cl)cc1Oc1cc(Cl)ccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.57
▸ ERN1 O75460 3/20 0.44
▸ TTR P02766 2/20 0.44
▸ RHEB Q15382 4/20 0.43
▸ LMNA P02545 3/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ HSPA5 P11021 1/20 0.38
▸ CBR1 P16152 1/20 0.38
▸ TBXA2R P21731 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38

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
SCHEMBL23709745 0.88 TDP1 (0.52) TDP1ERN1TTRRHEBLMNA
SCHEMBL16294809 0.88 LMNA (0.51) TDP1ERN1TTRRHEBLMNA
SCHEMBL20535203 0.83 HTR2A (0.51) TDP1ERN1ALDH1A1HSP90AA1SLC6A2
SCHEMBL9488215 0.82 RHEB (0.55) TDP1TTRRHEBLMNACYP1A2
SCHEMBL19563667 0.81 ALDH1A1 (0.50) TDP1ERN1TTRALDH1A1HPGD
SCHEMBL18570512 0.80 TTR (0.48) TDP1TTRRHEBLMNAMAPT
SCHEMBL20536242 0.79 LMNA (0.62) TDP1ERN1TTRLMNACYP1A2
SCHEMBL21143488 0.79 TDP1 (0.57) TDP1ERN1TTRLMNACYP1A2
SCHEMBL4515945 0.78 NPSR1 (0.46) TDP1ERN1LMNACYP1A2GAA
SCHEMBL4509584 0.78 TDP1 (0.44) TDP1ERN1TTRLMNACYP1A2

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 TDP1 2905/4885ERN1 3870/4885TTR 4120/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS TDP1 2657/4885ERN1 1744/4885TTR 3435/4885

“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.

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