SCHEMBL19912474

SCHEMBL19912474

N#Cc1cc(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)c(-c2cc(F)cc(C(F)(F)F)c2)c(-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 7/20 0.40
RXRA P19793 2/20 0.40
RXRG P48443 2/20 0.40
RXRB P28702 1/20 0.36
KIF11 P52732 3/20 0.35
TDP1 Q9NUW8 2/20 0.34
PTPN5 P54829 1/20 0.34
TAS2R14 Q9NYV8 1/20 0.34
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
TACR1 P25103 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL19903667 0.93 RXRA (0.43) PGRRXRARXRGKIF11TDP1
SCHEMBL22564341 0.93 RXRA (0.46) PGRRXRARXRGKIF11TDP1
SCHEMBL22564449 0.90 RXRA (0.43) PGRRXRARXRGKIF11TDP1
SCHEMBL19903468 0.90 RXRA (0.41) PGRRXRARXRGKIF11TDP1
SCHEMBL22156394 0.90 PGR (0.45) PGR
SCHEMBL20617259 0.87 PTPN5 (0.42) RXRARXRGKIF11PTPN5GRIN1
SCHEMBL22156427 0.87 PGR (0.43) PGRRXRARXRB
SCHEMBL20617412 0.87 KIF11 (0.47) RXRARXRGKIF11PTPN5TACR1
SCHEMBL19903566 0.87 KIF11 (0.47) RXRARXRGKIF11PTPN5TACR1
SCHEMBL22157481 0.86 KIF11 (0.39) PGRRXRARXRGRXRBKIF11

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 PGR 3081/4885RXRA 3635/4885RXRG 3474/4885

“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.