SCHEMBL19903533

SCHEMBL19903533

N#Cc1c(-n2c3ccccc3c3cc(C(F)(F)F)ccc32)cc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1-n1c2ccccc2c2cc(C(F)(F)F)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.41
HSP90AA1 P07900 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CTSS P25774 1/20 0.33
RXRA P19793 1/20 0.32
RXRG P48443 1/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ADORA1 P30542 1/20 0.31
RORC P51449 2/20 0.31
RORA P35398 1/20 0.31
RORB Q92753 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL19903669 0.94 KIF11 (0.39) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL20829447 0.94 KIF11 (0.39) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL20617070 0.94 RXRA (0.40) KIF11HSP90AA1ALDH1A1MAPTSMN1; SMN2
SCHEMBL19903495 0.94 KIF11 (0.39) KIF11HSP90AA1ALDH1A1MAPTSMN1; SMN2
SCHEMBL19903568 0.94 RXRA (0.35) KIF11HSP90AA1ALDH1A1MAPTSMN1; SMN2
SCHEMBL19903550 0.93 ICMT (0.37) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL19903519 0.93 KIF11 (0.47) KIF11HSP90AA1ALDH1A1MAPTSMN1; SMN2
SCHEMBL19903482 0.92 KIF11 (0.35) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL19918000 0.92 KIF11 (0.35) KIF11ALDH1A1MAPTSMN1; SMN2TDP1
SCHEMBL19903497 0.91 RXRA (0.36) KIF11RXRARXRGRORCTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10439151-B2 Organic molecules, especially for use in organic optoelectronic devices CYNORA GMBH (DE) 2019-10-08 US disclosed
EP-3360945-B1 ORGANIC ELECTROLUMINESCENT DEVICE CYNORA GMBH (DE) 2019-04-24 EP disclosed
EP-3287450-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-03-20 EP disclosed
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287450-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 EP 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 (2 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-10439151-B2 Organic molecules, especially for use in organic optoelectronic devices OR10J3, ORC3, AOC3 KIF11 3253/4885HSP90AA1 4855/4885ALDH1A1 901/4885
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 KIF11 3316/4885HSP90AA1 4864/4885ALDH1A1 817/4885

“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.