SCHEMBL19912341

SCHEMBL19912341

Cc1cc(-c2cc(-n3c4ccc(C)cc4c4cc(C)ccc43)c(C#N)c(-n3c4ccc(C)cc4c4cc(C)ccc43)c2)cc(C(F)(F)F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
NCOA1 Q15788 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
KIF11 P52732 1/20 0.33
MAPT P10636 1/20 0.33
XBP1 P17861 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
ATM Q13315 1/20 0.33
AR P10275 3/20 0.33
RXRA P19793 1/20 0.32
RXRG P48443 1/20 0.32
NOTUM Q6P988 1/20 0.32
GABRP O00591 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
SCHEMBL19912537 0.96 KIF11 (0.39) HTTPOLBLMNANCOA1SMN1; SMN2
SCHEMBL19903673 0.95 HTT (0.39) HTTPOLBLMNANCOA1SMN1; SMN2
SCHEMBL19912342 0.94 KIF11 (0.34) HTTPOLBLMNANCOA1SMN1; SMN2
SCHEMBL19912541 0.92 AR (0.40) HTTPOLBLMNANCOA1SMN1; SMN2
SCHEMBL22564570 0.92 RXRA (0.41) HTTPOLBLMNANCOA1SMN1; SMN2
SCHEMBL19912547 0.92 AR (0.34) POLBKIF11ALDH1A1GLAGAA
SCHEMBL19912529 0.92 KIF11 (0.38) HTTPOLBLMNANCOA1SMN1; SMN2
SCHEMBL19912559 0.91 RXRA (0.34) POLBALDH1A1GLAGAAHPGD
SCHEMBL19912377 0.91 RAPGEF3 (0.33) POLBKIF11RXRARXRGNOTUM
SCHEMBL19912338 0.90 POLB (0.35) HTTPOLBLMNANCOA1SMN1; SMN2

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 HTT 3519/4885POLB 2101/4885LMNA 4042/4885

“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.