SCHEMBL21116196

SCHEMBL21116196

Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2ccc(-c3ccc(-n4c5ccc(-c6ccc(C)cc6C)cc5c5cc(-c6ccc(C)cc6C)ccc54)cc3C#N)c(C#N)c2)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAOA P21397 3/20 0.34
MAOB P27338 3/20 0.34
HSP90AB1 P08238 2/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
AR P10275 1/20 0.33
GLS O94925 1/20 0.33
GLS2 Q9UI32 1/20 0.33
NR3C1 P04150 1/20 0.33
GRM2 Q14416 1/20 0.33
PRKCQ Q04759 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
SCHEMBL21116195 0.94 GRM2 (0.36) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL21132058 0.91 AR (0.35) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL21116369 0.90 LMNA (0.37) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL19954120 0.88 ALDH1A1 (0.37) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL21116215 0.87 AR (0.47) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL21116368 0.87 ALDH1A1 (0.39) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL20114708 0.86 HPGD (0.40) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL21131409 0.86 AR (0.37) ALDH1A1LMNAHPGDMAPK1SMN1; SMN2
SCHEMBL22985129 0.85 KDM1A (0.31)
SCHEMBL21116367 0.85 AR (0.45) ALDH1A1LMNAHPGDMAPK1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11271174-B2 Organic molecules for use in organic optoelectronic devices CYNORA GMBH (DE) 2022-03-08 US disclosed
US-20190198779-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-06-27 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 (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-20190198779-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, NOX3 ALDH1A1 2170/4885LMNA 2745/4885HPGD 3190/4885
US-11271174-B2 Organic molecules for use in organic optoelectronic devices OR10J3, ORC3, NOX3 ALDH1A1 2201/4885LMNA 2311/4885HPGD 2857/4885

“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.