SCHEMBL19183261

SCHEMBL19183261

CC(C)(C)OC(=O)NCC1CCN(S(=O)(=O)CC(=O)O)CC1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 1/20 0.45
SKP1 P63208 1/20 0.45
SKP2 Q13309 1/20 0.45
DRD2 P14416 2/20 0.44
ACACB O00763 11/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
ACACA Q13085 8/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL17718110 0.89 CKS1B (0.48) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL19183239 0.89 DRD2 (0.43) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL19201204 0.88 DRD2 (0.43) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL17718114 0.84 DRD2 (0.47) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL19201221 0.82 DRD2 (0.46) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL22165808 0.82 DRD2 (0.46) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL4554072 0.81 MAPT (0.58) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL17251891 0.81 KMT2A (0.45) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL8217502 0.79 ALDH1A1 (0.62) CKS1BSKP1SKP2DRD2ACACB
SCHEMBL22481998 0.79 DRD2 (0.43) CKS1BSKP1SKP2DRD2ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114230523-A Benzimidazole derivatives as modulators of ROR-gamma 生命医药有限责任公司 2022-03-25 CN disclosed
EP-3939974-A1 MODULATORS OF ROR-GAMMA Vitae Pharmaceuticals, LLC (US) 2022-01-19 EP disclosed
CN-109071509-B Benzimidazole derivatives as modulators of ROR-gamma 生命医药有限责任公司 2021-11-30 CN disclosed
EP-3408268-B1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS LLC (US) 2021-08-04 EP disclosed
US-20210094940-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2021-04-01 US disclosed
US-20210094940-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2021-04-01 US disclosed
US-10829481-B2 Benzimidazole derivatives as modulators of ROR-gamma VITAE PHARMACEUTICALS, LLC (US) 2020-11-10 US disclosed
US-10829481-B2 Benzimidazole derivatives as modulators of ROR-gamma VITAE PHARMACEUTICALS, LLC (US) 2020-11-10 US disclosed
US-20190352286-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2019-11-21 US disclosed
US-20190352286-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2019-11-21 US disclosed
CN-109071509-A BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA 生命医药公司 2018-12-21 CN disclosed
EP-3408268-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA Vitae Pharmaceuticals, Inc. (US) 2018-12-05 EP disclosed
WO-2017132432-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, INC. (US) 2017-08-03 WO disclosed
WO-2017132432-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, INC. (US) 2017-08-03 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 (3 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-20190352286-A1 BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA RORB, RORC, RORA CKS1B 508/4885SKP1 2103/4885SKP2 2814/4885
US-10829481-B2 Benzimidazole derivatives as modulators of ROR-gamma RORB, RORC, RORA CKS1B 572/4885SKP1 2591/4885SKP2 2839/4885
US-20210094940-A1 MODULATORS OF ROR-GAMMA RORC, RORB, RORA CKS1B 1272/4885SKP1 3784/4885SKP2 2436/4885

“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.