SCHEMBL17693150

SCHEMBL17693150

Cc1[nH]nnc1-c1ccnc(-c2ncn(C)c2-c2ccc(F)cc2OCCN2CCOCC2)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 7/20 0.56
▸ KDM5A P29375 2/20 0.53
▸ PHF8 Q9UPP1 6/20 0.53
▸ KDM2B Q8NHM5 4/20 0.53
▸ MAPK13 O15264 3/20 0.40
▸ MAPK12 P53778 3/20 0.40
▸ MAPK11 Q15759 3/20 0.40
▸ MAPK14 Q16539 3/20 0.40
▸ TGFBR1 P36897 1/20 0.38
▸ CDK1 P06493 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ CDK9 P50750 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ FLT3 P36888 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
SCHEMBL17693149 0.93 KDM4C (0.58) KDM4CKDM5APHF8KDM2B
SCHEMBL17693148 0.92 KDM4C (0.57) KDM4CKDM5APHF8KDM2B
SCHEMBL17621533 0.90 KDM4C (0.54) KDM4CKDM5APHF8KDM2BMAPK13
SCHEMBL17693163 0.90 KDM4C (0.43) KDM4CKDM5APHF8KDM2BMAPK13
SCHEMBL17693139 0.87 KDM4C (0.67) KDM4CKDM5APHF8KDM2B
SCHEMBL17693146 0.86 KDM4C (0.61) KDM4CKDM5APHF8KDM2B
SCHEMBL17693138 0.85 KDM4C (0.61) KDM4CKDM5APHF8KDM2B
SCHEMBL17693147 0.85 KDM4C (0.59) KDM4CKDM5APHF8KDM2B
SCHEMBL17693137 0.84 KDM4C (0.73) KDM4CKDM5APHF8KDM2B
SCHEMBL17693142 0.84 KDM4C (0.57) KDM4CKDM5APHF8KDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170240529-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2017-08-24 — — US disclosed
US-9676770-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-06-13 — — US disclosed
US-20160108033-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-04-21 — — 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-20170240529-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM4C 14/4885KDM5A 10/4885PHF8 35/4885
US-20160108033-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM4C 14/4885KDM5A 10/4885PHF8 35/4885

“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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