SCHEMBL16535474

SCHEMBL16535474

NC(=S)c1ccnc(CCC(F)(F)F)c1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.69
LMNA P02545 1/20 0.69
CYP3A4 P08684 1/20 0.69
TSHR P16473 1/20 0.69
CYP1A2 P05177 1/20 0.61
POLB P06746 1/20 0.61
ASH1L Q9NR48 5/20 0.35
LOXL2 Q9Y4K0 2/20 0.32
KDM5C P41229 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
PTK2 Q05397 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MBOAT4 Q96T53 1/20 0.30
NR3C2 P08235 1/20 0.30
LNPEP Q9UIQ6 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
Protionamide SCHEMBL30271512 0.81 KDM4E (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
Protionamide SCHEMBL74572 0.81 KDM4E (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
SCHEMBL28093033 0.77 KDM4E (0.84) KDM4ELMNACYP3A4TSHRCYP1A2
Ethionamide SCHEMBL12264086 0.76 CYP1A2 (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
Ethionamide SCHEMBL12264084 0.76 CYP1A2 (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
Ethionamide SCHEMBL12264091 0.76 CYP1A2 (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
Ethionamide SCHEMBL12264093 0.76 CYP1A2 (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
Ethionamide SCHEMBL12264085 0.76 CYP1A2 (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
Ethionamide SCHEMBL27007 0.76 CYP1A2 (1.00) KDM4ELMNACYP3A4TSHRCYP1A2
Ethionamide SCHEMBL12264090 0.76 CYP1A2 (1.00) KDM4ELMNACYP3A4TSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10183015-B2 Heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES LLC (US) 2019-01-22 US disclosed
EP-3038622-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECH LLC (US) 2018-05-30 EP disclosed
US-20180028518-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC 2018-02-01 US disclosed
EP-3265088-A1 SREBP BLOCKERS FOR USE IN TREATING LIVER FIBROSIS, ELEVATED CHOLESTEROL AND INSULIN RESISTANCE Medivation Technologies LLC (US) 2018-01-10 EP disclosed
US-9670172-B2 Heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2017-06-06 US disclosed
CN-106029072-A Heterocyclic compounds and methods of use 麦迪韦逊技术股份有限公司 2016-10-12 CN disclosed
EP-3038622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE Medivation Technologies, Inc. (US) 2016-07-06 EP disclosed
US-20150065519-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECHNOLOGIES LLC 2015-03-05 US disclosed
WO-2015031650-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE CHAKRAVARTY SARVAJIT (US) 2015-03-05 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-20150065519-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE HRAS, VHL, ESRRB KDM4E 3356/4885LMNA 2671/4885CYP3A4 2057/4885
US-20180028518-A1 Heterocyclic Compounds and Methods of Use LIPC, CPT1A, FABP1 KDM4E 2233/4885LMNA 999/4885CYP3A4 484/4885
US-10183015-B2 Heterocyclic compounds and methods of use LIPC, CPT1A, FABP1 KDM4E 2233/4885LMNA 999/4885CYP3A4 484/4885

“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.