SCHEMBL16305525

SCHEMBL16305525

CN(C)CCCNCc1cc(CN)ccn1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 2/20 0.44
▸ KDM5B Q9UGL1 7/20 0.41
▸ KDM5C P41229 6/20 0.41
▸ KDM5A P29375 5/20 0.41
▸ SIRT2 Q8IXJ6 3/20 0.41
▸ KDM4C Q9H3R0 2/20 0.41
▸ KDM5D Q9BY66 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CCNA2 P20248 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ FERMT2 Q96AC1 1/20 0.40
▸ LOXL2 Q9Y4K0 3/20 0.40
▸ LOX P28300 2/20 0.40
▸ KDM6B O15054 1/20 0.39
▸ KDM4A O75164 1/20 0.39
▸ KDM2B Q8NHM5 1/20 0.39
▸ LOXL3 P58215 1/20 0.39
▸ CHRM2 P08172 1/20 0.39
▸ ALOX15 P16050 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
SCHEMBL16292979 0.96 CHRM2 (0.41) TERTKDM5BKDM5CKDM5ASIRT2
SCHEMBL16305488 0.94 CHRM2 (0.43) TERTKDM5BKDM5CKDM5ASIRT2
SCHEMBL15994215 0.82 CHRM2 (0.42) KDM5BKDM5CKDM5ASIRT2KDM4C
SCHEMBL18860200 0.82 SIRT2 (0.41) TERTKDM5BKDM5CKDM5ASIRT2
SCHEMBL18017098 0.78 SIRT2 (0.42) TERTKDM5BKDM5CKDM5ASIRT2
SCHEMBL27208120 0.78 TERT (0.50) TERTTDP1CCNA2CDK2CHRM2
SCHEMBL16303307 0.77 SIRT2 (0.38) TERTKDM5BKDM5CKDM5ASIRT2
SCHEMBL16291904 0.77 KDM5B (0.65) KDM5BKDM5CKDM5ASIRT2KDM4C
SCHEMBL27208122 0.77 TDP1 (0.50) TERTTDP1CCNA2CDK2KDM6B
SCHEMBL16006936 0.77 CXCR4 (0.39) TERTKDM5BKDM5CKDM5ASIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2961736-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2018-04-11 — — EP claimed
US-9650339-B2 Inhibitors of histone demethylases GILEAD SCIENCES, INC. (US) 2017-05-16 — — US claimed
EP-2961736-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2018-04-11 — — EP disclosed
EP-2961736-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2018-04-11 — — EP disclosed
EP-3170811-A1 ETHYL PYRIDINE-4-CARBOXYLATE COMPOUND AS INHIBITOR OF HISTONE DEMETHYLASES Gilead Sciences, Inc. (US) 2017-05-24 — — EP disclosed
EP-3170811-A1 ETHYL PYRIDINE-4-CARBOXYLATE COMPOUND AS INHIBITOR OF HISTONE DEMETHYLASES Gilead Sciences, Inc. (US) 2017-05-24 — — EP disclosed
US-9650339-B2 Inhibitors of histone demethylases GILEAD SCIENCES, INC. (US) 2017-05-16 — — US disclosed
US-9650339-B2 Inhibitors of histone demethylases GILEAD SCIENCES, INC. (US) 2017-05-16 — — US disclosed
US-20160237037-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2016-08-18 — — US disclosed
US-20160237037-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2016-08-18 — — US disclosed
US-9221801-B2 Inhibitors of histone demethylases EPITHERAPEUTICS APS (DK) 2015-12-29 — — US disclosed
US-20140371214-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2014-12-18 — — 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 (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-20140371214-A1 INHIBITORS OF HISTONE DEMETHYLASES KDM1B, KDM1A, KDM3A TERT 1180/4885KDM5B 27/4885KDM5C 16/4885
US-20160237037-A1 INHIBITORS OF HISTONE DEMETHYLASES KDM1B, KDM1A, KDM3A TERT 1180/4885KDM5B 27/4885KDM5C 16/4885

“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.

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