SCHEMBL18878946

SCHEMBL18878946

Nc1ccnn2cnnc12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.38
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 4/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SMPD3 Q9NY59 1/20 0.33
MAPT P10636 1/20 0.33
ADORA2A P29274 1/20 0.33
LMNA P02545 1/20 0.33
HAVCR2 Q8TDQ0 1/20 0.32
GAA P10253 1/20 0.32
POLB P06746 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TOP2A P11388 1/20 0.30

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
SCHEMBL24548242 0.75 HTT (0.38) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL31679754 0.75 HTT (0.46) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8795590 0.75 KDM4E (0.50) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL11849070 0.72 KDM4E (0.38) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL400496 0.71 MAP4K4 (0.37) HTTKDM4EHAVCR2GAAPOLB
SCHEMBL11837892 0.71 SMPD3 (0.39) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9936556 0.71 HTT (0.35) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL4301919 0.71 HTT (0.35) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL749849 0.71 KDM4E (0.40) HTTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL9934743 0.71 HTT (0.35) HTTKDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250275965-A1 COMPOUNDS AS CASEIN KINASE INHIBITORS GRITSCIENCE BIOPHARMACEUTICALS CO LTD (CN) 2025-09-04 US disclosed
WO-2025080788-A1 CCR4 INHIBITORS AND METHODS OF USE THEREOF RAYTHERA, INC. (US) 2025-04-17 WO disclosed
WO-2022127755-A1 COMPOUNDS AS CASEIN KINASE INHIBITORS Gritscience Biopharmaceuticals Co., Ltd. (CN) 2022-06-23 WO disclosed
WO-2022127755-A1 COMPOUNDS AS CASEIN KINASE INHIBITORS Gritscience Biopharmaceuticals Co., Ltd. (CN) 2022-06-23 WO disclosed
US-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS EFFECTOR THERAPEUTICS, INC. 2017-05-25 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-20250275965-A1 COMPOUNDS AS CASEIN KINASE INHIBITORS PACSIN2, CSNK1A1, CSNK1G3 HTT 3664/4885KDM4E 1702/4885ALDH1A1 4346/4885
US-20170145009-A1 HETEROCYCLIC COMPOUNDS THAT INHIBIT THE KINASE ACTIVITY OF MNK USEFUL FOR TREATING VARIOUS CANCERS MAP3K9, MAP3K19, MAP3K20 HTT 4376/4885KDM4E 1316/4885ALDH1A1 4542/4885

“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.