SCHEMBL20536009

SCHEMBL20536009

COC(=O)c1cc2c(Cl)cc(Br)cc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 1/20 0.47
GRIN1 Q05586 1/20 0.46
EIF4A3 P38919 1/20 0.44
RHEB Q15382 3/20 0.42
CYP1A2 P05177 1/20 0.41
XDH P47989 3/20 0.41
NR4A2 P43354 2/20 0.38
FLT3 P36888 1/20 0.37
KIF11 P52732 1/20 0.36

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
SCHEMBL31651607 1.00 ULK1 (0.47) ULK1GRIN1EIF4A3RHEBCYP1A2
SCHEMBL26372677 0.86 ULK1 (0.48) ULK1GRIN1EIF4A3RHEBCYP1A2
SCHEMBL9433015 0.84 GRIN1 (0.66) ULK1GRIN1EIF4A3RHEBCYP1A2
SCHEMBL30995242 0.84 ALOX15 (0.52) GRIN1EIF4A3
SCHEMBL30995243 0.84 ALOX15 (0.52) GRIN1EIF4A3
SCHEMBL24020677 0.82 ULK1 (0.47) ULK1GRIN1EIF4A3RHEBCYP1A2
SCHEMBL30310492 0.82 ULK1 (0.53) ULK1CYP1A2XDHNR4A2FLT3
SCHEMBL20494852 0.82 ULK1 (0.53) ULK1CYP1A2XDHNR4A2FLT3
SCHEMBL19331121 0.82 ULK1 (0.53) ULK1GRIN1EIF4A3RHEBCYP1A2
SCHEMBL30310352 0.82 ULK1 (0.47) ULK1GRIN1EIF4A3RHEBCYP1A2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250214977-A1 STAT6 INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-07-03 US disclosed
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof NAVITOR PHARMACEUTICALS, INC. (US) 2022-05-24 US disclosed
US-11304929-B2 Tosylacetate based compounds and derivatives thereof as PHGDH inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-04-19 US disclosed
US-20220008386-A1 TOSYLACETATE BASED COMPOUNDS AND DERIVATIVES THEREOF AS PHGDH INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-01-13 US disclosed
US-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2021-08-05 US disclosed
EP-3596064-B1 TOSYLACETATE BASED COMPOUNDS AND DERIVATIVES THEREOF AS PHGDH INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-03-03 EP 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 (5 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-11304929-B2 Tosylacetate based compounds and derivatives thereof as PHGDH inhibitors PHGDH, G6PD, PHPT1 ULK1 2875/4885GRIN1 2362/4885EIF4A3 1815/4885
US-20210238165-A1 HETEROARYL RHEB INHIBITORS AND USES THEREOF RHEB, KRAS, NRAS ULK1 2667/4885GRIN1 4280/4885EIF4A3 943/4885
US-20250214977-A1 STAT6 INHIBITORS AND USES THEREOF STAT6, STAT5B, STAT5A ULK1 1355/4885GRIN1 4309/4885EIF4A3 1080/4885
US-11339144-B2 Heteroaryl Rheb inhibitors and uses thereof RHEB, GDI2, KRAS ULK1 1980/4885GRIN1 3080/4885EIF4A3 605/4885
US-20220008386-A1 TOSYLACETATE BASED COMPOUNDS AND DERIVATIVES THEREOF AS PHGDH INHIBITORS PHGDH, G6PD, PHPT1 ULK1 2875/4885GRIN1 2362/4885EIF4A3 1815/4885

“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.