SCHEMBL20210337

SCHEMBL20210337

Cc1ccc(C)c(N(C)c2c(C)c(C)c(C)c(C)c2C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
KMT2A Q03164 1/20 0.34
FGFR1 P11362 1/20 0.34
KDR P35968 1/20 0.34
EPHB4 P54760 1/20 0.34
LMNA P02545 2/20 0.33
TSHR P16473 2/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
CYP3A4 P08684 1/20 0.32
ADRA2A P08913 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2A6 P11509 2/20 0.32
TAAR1 Q96RJ0 1/20 0.31
KDM4E B2RXH2 2/20 0.31
RAPGEF4 Q8WZA2 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL20210338 0.85 RAPGEF4 (0.39) ALDH1A1TDP1KMT2AFGFR1KDR
SCHEMBL21793456 0.84 TDP1 (0.44) ALDH1A1TDP1KMT2AFGFR1KDR
SCHEMBL20210000 0.83 TDP1 (0.37) ALDH1A1TDP1TSHRHTTCYP3A4
SCHEMBL22336612 0.82 CYP1A2 (0.39) ALDH1A1TDP1KMT2AFGFR1KDR
SCHEMBL20210287 0.77 ALDH1A1 (0.46) ALDH1A1TDP1LMNATSHRPOLB
SCHEMBL20210027 0.77 TDP1 (0.38) ALDH1A1TDP1KMT2AFGFR1KDR
SCHEMBL20210152 0.76
SCHEMBL22336610 0.75 ALDH1A1 (0.37) ALDH1A1TDP1KMT2AFGFR1KDR
SCHEMBL20210302 0.75 CYP2A6 (0.41) ALDH1A1TDP1LMNATSHRPOLB
SCHEMBL3185975 0.75 TDP1 (0.44) ALDH1A1TDP1KMT2ALMNATSHR

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-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
EP-3544984-B1 BISBENZOFURAN-FUSED 2,8-DIAMINOINDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) MERCK PATENT GMBH (DE) 2020-12-23 EP 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
WO-2018095888-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) 2018-05-31 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-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 ALDH1A1 99/4885TDP1 339/4885KMT2A 2997/4885
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 ALDH1A1 99/4885TDP1 339/4885KMT2A 2997/4885

“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.