SCHEMBL19912487

SCHEMBL19912487

Cc1cccc(-c2ccc3c4ccccc4n(-c4cc(C#N)cc(-n5c6ccccc6c6ccc(-c7cccc(C)c7)cc65)c4-c4cc(C)cc(C(F)(F)F)c4)c3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.40
PTPN5 P54829 3/20 0.34
KIF11 P52732 1/20 0.33
RXRA P19793 1/20 0.33
RXRG P48443 1/20 0.33
GRIN1 Q05586 3/20 0.33
GRIN2B Q13224 3/20 0.33
MAT2A P31153 2/20 0.33
SYK P43405 1/20 0.32
TACR1 P25103 1/20 0.31
ICMT O60725 1/20 0.31
KDM4A O75164 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA4 P48058 1/20 0.31
PDE9A O76083 1/20 0.31
PDE1C Q14123 1/20 0.31
ENPP1 P22413 1/20 0.31

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
SCHEMBL22822599 0.97 AR (0.41) ARPTPN5KIF11RXRARXRG
SCHEMBL19903621 0.97 AR (0.41) ARPTPN5KIF11RXRARXRG
SCHEMBL19912472 0.95 RXRA (0.38) ARPTPN5KIF11RXRARXRG
SCHEMBL19912499 0.95 RXRA (0.36) ARKIF11RXRARXRGSYK
SCHEMBL19912485 0.94 AR (0.40) ARPTPN5KIF11RXRARXRG
SCHEMBL19912492 0.94 AR (0.36) ARPTPN5KIF11RXRARXRG
SCHEMBL19912503 0.94 RXRA (0.36) ARKIF11RXRARXRGSYK
SCHEMBL19917967 0.93 AR (0.44) ARPTPN5KIF11RXRARXRG
SCHEMBL22822601 0.93 AR (0.44) ARPTPN5KIF11RXRARXRG
SCHEMBL22822129 0.92 RXRA (0.38) ARPTPN5KIF11RXRARXRG

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 AR 4212/4885PTPN5 3658/4885KIF11 3316/4885

“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.