SCHEMBL16096648

SCHEMBL16096648

Oc1nc(OCc2ccccc2-c2ccccc2)nc2cnccc12

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KCNA5 P22460 3/20 0.40
▸ KCNH2 Q12809 2/20 0.40
▸ PIP4K2A P48426 5/20 0.40
▸ TNF P01375 1/20 0.39
▸ IKBKB O14920 2/20 0.39
▸ DHODH Q02127 3/20 0.38
▸ KDM4C Q9H3R0 2/20 0.38
▸ FFAR1 O14842 2/20 0.37
▸ FFAR4 Q5NUL3 2/20 0.37
▸ IDO1 P14902 1/20 0.34
▸ PDE5A O76074 1/20 0.34

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
SCHEMBL16095656 0.83 SGMS2 (0.40) KDM4CIDO1
SCHEMBL16095220 0.83 SGMS2 (0.40) KDM4CIDO1
SCHEMBL16095980 0.83 CNR1 (0.40) KDM4CFFAR1
SCHEMBL17503671 0.82 KDM4C (0.54) IKBKBKDM4CIDO1PDE5A
SCHEMBL16095204 0.80 SGMS2 (0.43) KDM4CFFAR1FFAR4IDO1
SCHEMBL16095992 0.80 KDM4C (0.45) IKBKBDHODHKDM4CFFAR1FFAR4
SCHEMBL19159311 0.79 KDM4C (0.34) DHODHKDM4CPDE5A
SCHEMBL16095989 0.79 CXCR2 (0.42) DHODHKDM4C
SCHEMBL19158889 0.79 ALOX12 (0.36) KDM4CIDO1
SCHEMBL16095927 0.79 IDO1 (0.38) KDM4CIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180319793-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-11-08 — — US claimed
US-20180319793-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-11-08 — — US disclosed
US-9994562-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-06-12 — — US disclosed
US-9994562-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-06-12 — — US disclosed
US-9994562-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-06-12 — — US disclosed
EP-2970211-B1 HISTONE DEMETHYLASE INHIBITORS QUANTICEL PHARMACEUTICALS INC (US) 2017-07-26 — — EP disclosed
EP-2970211-B1 HISTONE DEMETHYLASE INHIBITORS QUANTICEL PHARMACEUTICALS INC (US) 2017-07-26 — — EP disclosed
US-20160039808-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC 2016-02-11 — — US disclosed
US-20160039808-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC 2016-02-11 — — US disclosed
US-20160039808-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC 2016-02-11 — — US disclosed
EP-2970211-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 — — EP disclosed
WO-2014151106-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — WO disclosed
WO-2014151106-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — 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 (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-20180319793-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C KCNA5 3204/4885KCNH2 2931/4885PIP4K2A 1449/4885
US-20160039808-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C KCNA5 3204/4885KCNH2 2931/4885PIP4K2A 1449/4885

“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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