SCHEMBL21479953

SCHEMBL21479953

Cc1c(C)c(C)c(N(C)c2ccccc2)c(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.41
FAAH O00519 1/20 0.40
PHGDH O43175 1/20 0.40
MGLL Q99685 1/20 0.40
CHKA P35790 3/20 0.38
NR3C2 P08235 1/20 0.38
GAA P10253 1/20 0.38
EGFR P00533 1/20 0.37
PTPN1 P18031 1/20 0.37
CES1 P23141 1/20 0.37
GSK3B P49841 1/20 0.36
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
PDE5A O76074 1/20 0.35
S1PR4 O95977 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL21479952 0.87 TAAR1 (0.41) MEN1KMT2ACHKAGSK3BPDE5A
SCHEMBL20210148 0.80 ALDH1A1 (0.52) EGFRCES1CA9CA1CA2
SCHEMBL12619746 0.79 EGFR (0.42) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL15362296 0.78 TSHR (0.41) MEN1KMT2AHTTFAAHPHGDH
Benzene SCHEMBL14537401 0.78 MEN1 (0.52) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL6567354 0.78 MEN1 (0.52) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL22931682 0.78 MEN1 (0.52) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL31886 0.78 MEN1 (0.52) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL20385081 0.78 MEN1 (0.52) MEN1KMT2AHTTFAAHPHGDH
SCHEMBL12018936 0.77 ALDH1A1 (0.42) MEN1KMT2AHTTFAAHPHGDH

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-11584753-B2 Bisbenzofuran-fused 2,8-diaminoindeno[1,2-b]fluorene derivatives and related compounds as materials for organic electroluminescent devices (OLED) MERCK PATENT GMBH (DE) 2023-02-21 US disclosed
US-20190315764-A1 BISBENZOFURAN-FUSED 2,8-DIAMINOINDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) MERCK PATENT GMBH (DE) 2019-10-17 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-20190315764-A1 BISBENZOFURAN-FUSED 2,8-DIAMINOINDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) OCIAD1, OCIAD2, AOC1 MEN1 2637/4885KMT2A 2997/4885HTT 4259/4885
US-11584753-B2 Bisbenzofuran-fused 2,8-diaminoindeno[1,2-b]fluorene derivatives and related compounds as materials for organic electroluminescent devices (OLED) OCIAD1, OCIAD2, AOC1 MEN1 2637/4885KMT2A 2997/4885HTT 4259/4885

“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.