SCHEMBL20910849

SCHEMBL20910849

Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c(-c3cc(C(F)(F)F)ccc3-n3c4ccccc4c4cc(-c5ccc(C)cc5C)ccc43)c2)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.33
▸ PPARA Q07869 2/20 0.33
▸ KIF11 P52732 1/20 0.31
▸ GCGR P47871 1/20 0.31
▸ DHODH Q02127 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ ABCG2 Q9UNQ0 3/20 0.30
▸ NR3C1 P04150 1/20 0.30
▸ PGR P06401 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ PDE2A O00408 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
SCHEMBL20911042 0.97 DHODH (0.32) PPARGPPARAGCGRDHODHADORA3
SCHEMBL20910992 0.93 NR3C1 (0.35) PPARGPPARAKIF11GCGRDHODH
SCHEMBL20910722 0.93 PPARG (0.35) PPARGPPARAKIF11CYP1A2CYP3A4
SCHEMBL20910845 0.92 PPARG (0.33) PPARGPPARAKIF11DHODHADORA3
SCHEMBL20910990 0.92 DHODH (0.34) PPARGPPARAKIF11GCGRDHODH
SCHEMBL20910988 0.92 PPARG (0.35) PPARGPPARAKIF11ABCG2NR3C1
SCHEMBL20910534 0.91 KIF11 (0.33) KIF11GCGRDHODHADORA3CYP1A2
SCHEMBL20910541 0.91 KIF11 (0.34) KIF11GCGRDHODHADORA3CYP1A2
SCHEMBL21090058 0.90 DHODH (0.35) GCGRDHODHADORA3CYP1A2CYP3A4
SCHEMBL20910724 0.90 CYP1A2 (0.35) PPARGPPARAKIF11DHODHCYP1A2

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-10998504-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-05-04 — — US disclosed
US-20190115544-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-04-18 — — 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-10998504-B2 Organic molecules for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 PPARG 651/4885PPARA 1252/4885KIF11 451/4885
US-20190115544-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD1, OCIAD2, POU2F1 PPARG 651/4885PPARA 1252/4885KIF11 451/4885

“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.

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