SCHEMBL22163584

SCHEMBL22163584

CN1CCN(Cc2cccc(N(C)c3ccc(Cc4nc(O)c5ccncc5n4)cc3)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 13/20 0.59
▸ AOC3 Q16853 1/20 0.39
▸ CHKA P35790 1/20 0.39
▸ BRAF P15056 1/20 0.36
▸ EIF2AK3 Q9NZJ5 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ TNF P01375 1/20 0.36
▸ P2RX7 Q99572 1/20 0.35

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
SCHEMBL17602119 0.84 KDM4C (0.69) KDM4C
SCHEMBL29542310 0.84 KDM4C (0.69) KDM4C
SCHEMBL19268159 0.78 KDM4C (0.43) KDM4C
SCHEMBL19268161 0.76 LATS1 (0.42) KDM4C
SCHEMBL19268158 0.76 EGFR (0.43) KDM4C
SCHEMBL22163336 0.75 KDM4C (0.50) KDM4C
SCHEMBL19268162 0.75 MTNR1A (0.44) KDM4C
SCHEMBL19268156 0.74 EGFR (0.38) KDM4C
SCHEMBL29874566 0.74 MC4R (0.50) KDM4CCHKA
SCHEMBL17602275 0.74 MC4R (0.50) KDM4CCHKA

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-10815234-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2020-10-27 — — US disclosed
US-20200199122-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2020-06-25 — — 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-20200199122-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C KDM4C 9/4885AOC3 2639/4885CHKA 879/4885
US-10815234-B2 Histone demethylase inhibitors KDM1B, KDM1A, KDM5C KDM4C 9/4885AOC3 2639/4885CHKA 879/4885

“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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