SCHEMBL20535690

SCHEMBL20535690

Nc1cc(Cl)c(OCCc2ccccc2)cc1N

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
HPGD P15428 1/20 0.44
HTR2C P28335 1/20 0.44
SLC6A4 P31645 1/20 0.44
HTR2B P41595 1/20 0.44
HTR6 P50406 1/20 0.44
SCN9A Q15858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
GPR84 Q9NQS5 2/20 0.42
DRD4 P21917 1/20 0.40
MAPK14 Q16539 1/20 0.40

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
SCHEMBL20536647 0.87 RHEB (0.50) HTR2CSLC6A4HTR2BHTR6SMN1; SMN2
SCHEMBL20535507 0.83 GAA (0.51) NPC1RAB9AHPGDSMN1; SMN2MAPK14
SCHEMBL11360859 0.82 NPC1 (0.56) NPC1RAB9AHPGDHTR2CSLC6A4
SCHEMBL20536393 0.82 PIN1 (0.51) NPC1RAB9AHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL11354651 0.81 NPC1 (0.54) NPC1RAB9AHPGDHTR2CSLC6A4
SCHEMBL13812974 0.79 HTR2C (0.56) NPC1RAB9AHTR2CSLC6A4HTR2B
SCHEMBL20535985 0.78 HPGD (0.46) NPC1RAB9AHPGDSCN9ASMN1; SMN2
SCHEMBL9705397 0.77 L3MBTL1 (0.51) NPC1RAB9AHPGDSMN1; SMN2DRD4
SCHEMBL19612232 0.77 NPC1 (0.53) NPC1RAB9AHPGDHTR2CSLC6A4
SCHEMBL28984994 0.76 IDO1 (0.48) HPGDGPR84

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 NPC1 868/4885RAB9A 35/4885HPGD 1852/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS NPC1 403/4885RAB9A 31/4885HPGD 2380/4885

“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.