SCHEMBL21479951

SCHEMBL21479951

Cc1cc(C)c(N(C)c2ccc(-c3ccccc3)cc2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 3/20 0.41
TAAR1 Q96RJ0 1/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CHKA P35790 2/20 0.37
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35
PDE10A Q9Y233 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GSK3B P49841 1/20 0.34

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
SCHEMBL18719354 0.88 CYP1A2 (0.40) LMNACHKACYP1A2CYP2A6MEN1
SCHEMBL16344198 0.82 PSMB5 (0.42) PSMB5TAAR1ALDH1A1LMNASMN1; SMN2
SCHEMBL12249552 0.82 CHKA (0.41) PSMB5TAAR1ALDH1A1LMNASMN1; SMN2
SCHEMBL20210147 0.81 ALDH1A1 (0.50) ALDH1A1
SCHEMBL20210324 0.80 SMN1; SMN2 (0.37) PSMB5TAAR1ALDH1A1LMNASMN1; SMN2
SCHEMBL21479952 0.80 TAAR1 (0.41) TAAR1ALDH1A1LMNASMN1; SMN2CHKA
SCHEMBL12249808 0.79 ALDH1A1 (0.48) TAAR1ALDH1A1LMNASMN1; SMN2CHKA
SCHEMBL21787742 0.79 PSMB5 (0.40) PSMB5TAAR1ALDH1A1LMNASMN1; SMN2
SCHEMBL19241177 0.79 MEN1 (0.40) PSMB5ALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL6723671 0.79 ALDH1A1 (0.50) TAAR1ALDH1A1LMNASMN1; SMN2CHKA

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 PSMB5 4727/4885TAAR1 420/4885ALDH1A1 99/4885
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 PSMB5 4727/4885TAAR1 420/4885ALDH1A1 99/4885

“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.