SCHEMBL18858280

SCHEMBL18858280

Fc1nc(F)nc(-c2cccc(-c3nccc4ccccc34)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
KMT2A Q03164 2/20 0.46
GLA P06280 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TDO2 P48775 5/20 0.43
GPR55 Q9Y2T6 1/20 0.43
MAPK1 P28482 2/20 0.40
HDAC6 Q9UBN7 1/20 0.39
HTR2B P41595 1/20 0.38
HTR5A P47898 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CYP2C19 P33261 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
SCHEMBL18327498 0.86 MAPT (0.53) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL17413794 0.86 MAPT (0.53) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL29607745 0.86 KDM4E (0.57) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL17449880 0.86 KDM4E (0.57) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL18858309 0.85 MAPT (0.51) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL17945790 0.84 KDM4E (0.50) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL18327514 0.84 MAPT (0.50) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL18325294 0.82 L3MBTL1 (0.47) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL17932557 0.82 KDM4E (0.46) KDM4ENPC1RAB9AMAPTL3MBTL1
SCHEMBL17944664 0.82 HTR2B (0.50) KDM4ENPC1RAB9AMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230403927-A1 AROMATIC COMPOUNDS UDC IRELAND LTD (IE) 2023-12-14 US disclosed
US-20230403927-A1 AROMATIC COMPOUNDS UDC IRELAND LTD (IE) 2023-12-14 US disclosed
US-11800787-B2 Metal complexes UDC IRELAND LIMITED (IE) 2023-10-24 US disclosed
US-11800787-B2 Metal complexes UDC IRELAND LIMITED (IE) 2023-10-24 US disclosed
EP-3160976-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2019-07-24 EP disclosed
US-20170141329-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2017-05-18 US disclosed
US-20170141329-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2017-05-18 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 (3 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-20230403927-A1 AROMATIC COMPOUNDS TYR, CTCF, MITF KDM4E 1344/4885NPC1 3191/4885RAB9A 2503/4885
US-20170141329-A1 METAL COMPLEXES AP1M1, SOD1, AP3M1 KDM4E 3544/4885NPC1 3855/4885RAB9A 1927/4885
US-11800787-B2 Metal complexes AP1M1, SOD1, AP3M1 KDM4E 3544/4885NPC1 3855/4885RAB9A 1927/4885

“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.