SCHEMBL22490163

SCHEMBL22490163

Fc1ccc2c(ccc3ccncc32)c1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HIPK2 Q9H2X6 1/20 0.53
ACHE P22303 1/20 0.47
MAPK10 P53779 4/20 0.45
KDM4E B2RXH2 2/20 0.44
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
RAD52 P43351 1/20 0.44
MAPT P10636 4/20 0.44
CHUK O15111 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.41
CLK1 P49759 1/20 0.40
DYRK1A Q13627 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2A6 P11509 1/20 0.39
TDO2 P48775 1/20 0.39
MAOA P21397 2/20 0.39
P4HB P07237 1/20 0.38

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
SCHEMBL23557738 0.86 CHUK (0.47) HIPK2ACHEKDM4EHTTMAPT
SCHEMBL25625877 0.85 CHUK (0.46) HIPK2ACHEKDM4EHTTMAPT
SCHEMBL13338179 0.80 HIPK2 (0.43) HIPK2ACHEMAPK10KDM4EHTT
SCHEMBL11144191 0.79 PRKCZ (0.50) ACHEMAPTCHUKCLK1DYRK1A
SCHEMBL30387605 0.79 MAPT (0.53) ACHEMAPTCHUKCYP1A2CYP2A6
SCHEMBL29875363 0.79 PRKCZ (0.50) ACHEMAPTCHUKCLK1DYRK1A
SCHEMBL1551786 0.79 MAPT (0.53) ACHEMAPTCHUKCYP1A2CYP2A6
SCHEMBL4097686 0.79 ACHE (0.46) HIPK2ACHEMAPK10KDM4EHTT
SCHEMBL672509 0.78 CLK1 (0.54) HIPK2ACHEMAPK10KDM4EHTT
SCHEMBL29569821 0.78 CLK1 (0.54) HIPK2ACHEMAPK10KDM4EHTT

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-20200308205-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2020-10-01 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-20200308205-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE CYBA, CYC1, CRY2 HIPK2 2154/4885ACHE 1169/4885MAPK10 4450/4885

“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.