SCHEMBL2444183

SCHEMBL2444183

CC(=O)OC(C)C(=O)N1CCC(CCOS(=O)(=O)c2ccc(C)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MDM2 Q00987 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP3A4 P08684 1/20 0.38
LMNA P02545 2/20 0.38
GPR119 Q8TDV5 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL2444180 1.00 KDM4E (0.39) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL3116309 0.89 MEN1 (0.40) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL3119390 0.89 MEN1 (0.40) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL3116317 0.89 MEN1 (0.40) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL3745483 0.88 NPC1 (0.42) KDM4ENPC1RAB9AMDM2ALDH1A1
SCHEMBL2446754 0.86 ALDH1A1 (0.43) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL3120504 0.84 MBOAT4 (0.46) KDM4ECYP3A4LMNAPOLB
SCHEMBL3120493 0.84 MBOAT4 (0.46) KDM4ECYP3A4LMNAPOLB
SCHEMBL3753204 0.83 GPR119 (0.41) KDM4EKMT2AALDH1A1CYP3A4LMNA
SCHEMBL3753200 0.83 GPR119 (0.41) KDM4EKMT2AALDH1A1CYP3A4LMNA

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-8017780-B1 Therapeutic compounds and uses thereof MYREXIS, INC. (US) 2011-09-13 US disclosed
US-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders MYRIAD PHARMACEUTICALS, INC. (US) 2010-11-18 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 (1 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-20100292255-A1 Therapeutic Compounds and Their Use in Treating Diseases and Disorders VHL, CLN6, CFTR KDM4E 3910/4885MEN1 688/4885KMT2A 3251/4885

“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.