SCHEMBL21644727

SCHEMBL21644727

Fc1ccc(-c2cc3ccccc3c(-c3ccc(F)cc3)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.50
CYP19A1 P11511 1/20 0.48
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
SCN9A Q15858 2/20 0.43
MAPT P10636 5/20 0.43
KDM4E B2RXH2 1/20 0.43
PDGFRB P09619 1/20 0.43
MAPK10 P53779 1/20 0.42
MAPK14 Q16539 1/20 0.42
BCHE P06276 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SQOR Q9Y6N5 1/20 0.41
TOP1 P11387 2/20 0.41
NPC1 O15118 1/20 0.41
MAOB P27338 1/20 0.41
CASP3 P42574 1/20 0.41

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
SCHEMBL30497936 1.00 ADORA2A (0.50) ADORA2ACYP19A1ALDH1A1SMN1; SMN2SCN9A
SCHEMBL13327614 0.85 ALDH1A1 (0.50) ADORA2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL29446790 0.85 KDM4E (0.53) ADORA2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL30616770 0.85 KDM4E (0.53) ADORA2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL3318116 0.85 KDM4E (0.53) ADORA2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL30497940 0.81 MAP2K4 (0.50) ADORA2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL21644724 0.81 MAP2K4 (0.50) ADORA2AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL16436822 0.81 MEN1 (0.56) ADORA2AALDH1A1MAPTKDM4EMAPK1
SCHEMBL13559025 0.81 MEN1 (0.46) ADORA2ACYP19A1ALDH1A1SMN1; SMN2MAPT
SCHEMBL7258823 0.81 CYP19A1 (0.47) ADORA2ACYP19A1ALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11362287-B2 Luminescent cyclometalating tridentate ligand-containing gold(III) compounds with aryl auxiliary ligands for organic light-emitting devices and their preparation thereof THE UNIVERSITY OF HONG KONG (HK) 2022-06-14 US disclosed
US-20200044167-A1 LUMINESCENT CYCLOMETALATING TRIDENTATE LIGAND-CONTAINING GOLD(III) COMPOUNDS WITH ARYL AUXILIARY LIGANDS FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION THEREOF UNIV HONG KONG (HK) 2020-02-06 US disclosed
CN-110088228-A Luminescent gold (III) compound containing Cyclometalated tridentate ligand and its preparation for organic light emitting apparatus with aryl assistant ligand 香港大学 2019-08-02 CN 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-20200044167-A1 LUMINESCENT CYCLOMETALATING TRIDENTATE LIGAND-CONTAINING GOLD(III) COMPOUNDS WITH ARYL AUXILIARY LIGANDS FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION THEREOF CBR3, NR4A3, NR2C2 ADORA2A 2665/4885CYP19A1 3781/4885ALDH1A1 4270/4885
US-11362287-B2 Luminescent cyclometalating tridentate ligand-containing gold(III) compounds with aryl auxiliary ligands for organic light-emitting devices and their preparation thereof CBR3, NR4A3, NR2C2 ADORA2A 2665/4885CYP19A1 3781/4885ALDH1A1 4270/4885

“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.