Sugi Predict

Sugi Predict / Compounds / SCHEMBL16638227

SCHEMBL16638227

SCHEMBL16638227

CCCC(C)(C)c1cc(Oc2cc(C#N)c(C#N)cc2Oc2cc(C(C)(C)CCC)c(OC)cc2C(C)(C)CCC)c(C(C)(C)CCC)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 12/20 0.40
▸ KDM4E B2RXH2 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ NR3C1 P04150 5/20 0.35
▸ NR3C2 P08235 5/20 0.35
▸ PGR P06401 3/20 0.34
▸ IMPDH2 P12268 1/20 0.33
▸ IMPDH1 P20839 1/20 0.33

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
SCHEMBL16638226 0.91 AR (0.36) ARKDM4EUSP2ALDH1A1NR3C1
SCHEMBL16638230 0.91 AR (0.40) ARNR3C1NR3C2PGR
SCHEMBL16638555 0.81 TP53 (0.44) KDM4ENR3C1NR3C2
SCHEMBL25968794 0.74 AR (0.42) ARNR3C1NR3C2PGR
SCHEMBL16638223 0.73 LMNA (0.38) —
SCHEMBL31542099 0.72 ALOX15 (0.58) ARKDM4EALDH1A1
SCHEMBL8749333 0.72 ALOX15 (0.58) ARKDM4EALDH1A1
SCHEMBL11259141 0.72 LMNA (0.37) —
SCHEMBL23666044 0.68 HTR2A (0.35) NR3C1NR3C2PGR
SCHEMBL22215619 0.68 NQO1 (0.43) KDM4EALDH1A1NR3C1NR3C2

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-9006428-B2 High transmissional green dye for LCD and synthetic method thereof LG DISPLAY CO., LTD. (KR) 2015-04-14 — — US disclosed
US-9006428-B2 High transmissional green dye for LCD and synthetic method thereof LG DISPLAY CO., LTD. (KR) 2015-04-14 — — US disclosed