SCHEMBL18074013

SCHEMBL18074013

CC(C)[C@H]1CCN(S(=O)(=O)C(C)C)C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.41
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
JAK2 O60674 2/20 0.35
JAK1 P23458 1/20 0.35
LMNA P02545 1/20 0.33
CCL5 P13501 1/20 0.32
CCR5 P51681 1/20 0.32
FAAH O00519 1/20 0.32
PIK3CD O00329 1/20 0.30
MCOLN3 Q8TDD5 1/20 0.30
JAK3 P52333 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL10232864 1.00 EPHX2 (0.41) EPHX2MEN1KMT2AJAK2JAK1
SCHEMBL20756318 0.89 MEN1 (0.44) EPHX2MEN1KMT2AJAK2JAK1
SCHEMBL2603251 0.88 EPHX2 (0.46) EPHX2MEN1KMT2AJAK2JAK1
SCHEMBL23261695 0.87 EPHX2 (0.44) EPHX2MEN1KMT2AJAK2JAK1
SCHEMBL23126815 0.85 EPHX2 (0.39) EPHX2MEN1KMT2AJAK2JAK1
SCHEMBL26145129 0.85 EPHX2 (0.39) EPHX2MEN1KMT2AJAK2JAK1
SCHEMBL17755705 0.83 EPHX2 (0.34) EPHX2MEN1KMT2ACCL5CCR5
SCHEMBL13368879 0.82 TSHR (0.44) MEN1KMT2A
SCHEMBL10232861 0.82 L3MBTL1 (0.38) EPHX2LMNA
SCHEMBL12384515 0.82 TSHR (0.44) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190292167-A1 HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2019-09-26 US disclosed
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES SYROS PHARMACEUTICALS INC (US) 2016-09-15 US 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-20190292167-A1 HETEROAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES CDK7, CDK3, CDK17 EPHX2 2688/4885MEN1 671/4885KMT2A 1580/4885
US-20160264552-A1 HETEROMAROMATIC COMPOUNDS USEFUL FOR THE TREATMENT OF PROLFERATIVE DISEASES CDK7, CDK6, CDK3 EPHX2 3769/4885MEN1 1073/4885KMT2A 2159/4885

“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.