SCHEMBL21479961

SCHEMBL21479961

Cc1c(C)c(C)c(N(C)c2ccc(C(C)(C)C)cc2)c(C)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
LMNA P02545 2/20 0.38
TYR P14679 1/20 0.38
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 2/20 0.36
KCNH2 Q12809 1/20 0.35
SLC2A1 P11166 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
RAB9A P51151 3/20 0.33
KIF11 P52732 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 2/20 0.32
POLB P06746 1/20 0.32
ALOX15 P16050 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32

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
SCHEMBL20102785 0.83 TSHR (0.44) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL1134090 0.82 TSHR (0.50) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL20172774 0.80 TSHR (0.46) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL10296037 0.80 TSHR (0.41) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL20172773 0.78 TSHR (0.68) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL20210148 0.78 ALDH1A1 (0.52) TSHRLMNAALDH1A1HSD17B10RAB9A
SCHEMBL24145271 0.76 KIF11 (0.52) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL5294134 0.74 MEN1 (0.50) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL13826140 0.74 TSHR (0.48) TSHRLMNATYRALDH1A1HSD17B10
SCHEMBL13367482 0.73 TSHR (0.48) TSHRLMNATYRALDH1A1HSD17B10

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 3 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

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 TSHR 4385/4885LMNA 2227/4885TYR 817/4885
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 TSHR 4385/4885LMNA 2227/4885TYR 817/4885

“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.