SCHEMBL12640441

SCHEMBL12640441

Cc1cccc(-c2cc(-c3cccc(C)c3)cc(N(c3cccc(C#N)c3)c3ccc4ccc5c(N(c6cccc(C#N)c6)c6cc(-c7cccc(C)c7)cc(-c7cccc(C)c7)c6)ccc6ccc3c4c65)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.34
MAPK14 Q16539 1/20 0.33
ALDH1A1 P00352 4/20 0.33
CYP1A2 P05177 4/20 0.33
LMNA P02545 3/20 0.33
CYP2C9 P11712 3/20 0.33
TSHR P16473 3/20 0.33
HSD17B10 Q99714 3/20 0.33
TP53 P04637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SYK P43405 1/20 0.33
AR P10275 1/20 0.33
CYP3A4 P08684 3/20 0.32
CLK4 Q9HAZ1 3/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C19 P33261 2/20 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
SCHEMBL12640477 0.93 KCNN4 (0.33) PGRMAPK14ALDH1A1CYP1A2LMNA
SCHEMBL12576004 0.91
SCHEMBL12640535 0.90 F9 (0.34) PGRMAPK14ALDH1A1CYP1A2LMNA
SCHEMBL12640527 0.90 MAPK14 (0.38) MAPK14ARIDO1GSK3A
SCHEMBL12640613 0.89 MEN1 (0.35) PGRALDH1A1CYP1A2LMNACYP2C9
SCHEMBL12640421 0.89 ALDH1A1 (0.36) PGRALDH1A1CYP1A2LMNACYP2C9
SCHEMBL12640517 0.87 GABRG2 (0.40) PGRALDH1A1CYP1A2LMNATSHR
SCHEMBL12640488 0.86 PGR (0.34) PGRALDH1A1ARGSK3AMEN1
SCHEMBL12640564 0.85 MYC (0.35) PGRALDH1A1CYP1A2LMNACYP2C9
SCHEMBL12640532 0.85 MAPK14 (0.32) PGRMAPK14ALDH1A1CYP1A2LMNA

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-9126892-B2 Blue fluorescence compound and organic electroluminescence device using the same LG DISPLAY CO., LTD. (KR) 2015-09-08 US disclosed
US-20110156011-A1 BLUE FLUORESCENCE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LG DISPLAY CO., LTD. (KR) 2011-06-30 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 (1 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-20110156011-A1 BLUE FLUORESCENCE COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME KCNN2, ORAI2, ETV6 PGR 3326/4885MAPK14 1999/4885ALDH1A1 561/4885

“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.