SCHEMBL22077620

SCHEMBL22077620

c1ccc(-c2cc(-c3ccccc3)cc(-c3cc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc(-c4ccccc4)n3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.39
CYP19A1 P11511 1/20 0.39
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
RAB9A P51151 1/20 0.37
ADORA1 P30542 2/20 0.37
ADORA2A P29274 1/20 0.37
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
LMNA P02545 1/20 0.35
MAPK10 P53779 1/20 0.35
AGTR1 P30556 2/20 0.34
ADORA3 P0DMS8 1/20 0.34
ADORA2B P29275 1/20 0.34
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL17031654 0.99 PDK2 (0.40) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL17031675 0.97 MEN1 (0.39) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL21578583 0.94 PDK2 (0.40) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL22073950 0.94 PDK2 (0.40) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL21578585 0.94 PDK2 (0.42) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL17031652 0.94 MEN1 (0.41) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL22074135 0.93 PDK2 (0.40) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL21168538 0.93 PDK2 (0.40) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL23873846 0.93 PDK2 (0.38) PDK2CYP19A1MEN1KMT2ARAB9A
SCHEMBL22074177 0.93 PDK2 (0.40) PDK2CYP19A1MEN1KMT2ARAB9A

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-20200185615-A1 ORGANIC CHEMICAL COMPOUND, ORGANIC MIXTURE, AND ORGANIC ELECTRONIC COMPONENT GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2020-06-11 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-20200185615-A1 ORGANIC CHEMICAL COMPOUND, ORGANIC MIXTURE, AND ORGANIC ELECTRONIC COMPONENT OSTC, ODC1, ORC3 PDK2 1506/4885CYP19A1 98/4885MEN1 1043/4885

“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.