SCHEMBL21155987

SCHEMBL21155987

c1ccc(-c2ccc(-c3nc(-n4c5cccnc5c5c6ccccc6c6c7ccccc7sc6c54)nc4ccccc34)c3ccccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.33
TOP1 P11387 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CKS1B P61024 1/20 0.30
GLO1 Q04760 1/20 0.30
SKP2 Q13309 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL19988518 0.92 ALDH1A1 (0.39) L3MBTL1KDM4EALDH1A1HPGDLMNA
SCHEMBL21155414 0.91 TOP2A (0.30)
SCHEMBL19988497 0.91 TOP2A (0.33) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL19988657 0.91 ALDH1A1 (0.38) L3MBTL1KDM4EALDH1A1HPGDLMNA
SCHEMBL19988463 0.90 ALDH1A1 (0.34) L3MBTL1KDM4EALDH1A1HPGDLMNA
SCHEMBL19988514 0.89 ALDH1A1 (0.34) L3MBTL1KDM4EALDH1A1HPGDLMNA
SCHEMBL19988509 0.89 PIK3CD (0.31)
SCHEMBL19988447 0.88 ALDH1A1 (0.39) L3MBTL1KDM4EALDH1A1HPGDLMNA
SCHEMBL19988658 0.87 KRAS (0.36) KDM4EALDH1A1
SCHEMBL19988445 0.86 ALDH1A1 (0.35) L3MBTL1KDM4EALDH1A1HPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512848-B1 COMPOUNDS WITH CARBAZOLE STRUCTURES MERCK PATENT GMBH (DE) 2020-11-18 EP disclosed
US-20190214574-A1 COMPOUNDS WITH CARBAZOLE STRUCTURES MERCK PATENT GMBH (DE) 2019-07-11 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-20190214574-A1 COMPOUNDS WITH CARBAZOLE STRUCTURES CYCS, CYP3A4, CYP2E1 L3MBTL1 4160/4885KDM4E 2638/4885ALDH1A1 506/4885

“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.