SCHEMBL19006033

SCHEMBL19006033

CC(C)c1c[nH]c2c1CCCC2

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL25754105 0.96 MAPT (0.30)
SCHEMBL8005765 0.78 PTGS1 (0.35) KDM4EALDH1A1
SCHEMBL21120702 0.78 GABRA1 (0.32)
SCHEMBL21743160 0.75 NISCH (0.39) KDM4E
SCHEMBL7817311 0.73 ALOX15 (0.33)
SCHEMBL17229700 0.71 KCNK3 (0.32) ALDH1A1
SCHEMBL25873389 0.71 TSHR (0.32)
SCHEMBL17229720 0.70 F12 (0.31) ALDH1A1
SCHEMBL17229693 0.70 KDR (0.36) ALDH1A1
SCHEMBL17229772 0.70 TSHR (0.32) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230047905-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-02-16 US disclosed
US-10336727-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2019-07-02 US disclosed
US-10040779-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-08-07 US disclosed
US-20170174656-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2017-06-22 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 (4 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-10040779-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM5C KDM4E 16/4885ALDH1A1 306/4885
US-20170174656-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM5C KDM4E 16/4885ALDH1A1 306/4885
US-20230047905-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 KDM4E 3761/4885ALDH1A1 4654/4885
US-10336727-B2 Histone demethylase inhibitors KDM1B, KDM5A, KDM5C KDM4E 16/4885ALDH1A1 306/4885

“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.