SCHEMBL20714950

SCHEMBL20714950

c1ccc(-c2nc(-c3ccccc3)c3oc4ccc(-c5cccc(-n6c7ccc(-c8ccc9oc%10ccccc%10c9c8)cc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)c5)cc4c3n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
TSHR P16473 5/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 10/20 0.37
KDM4E B2RXH2 4/20 0.36
POLB P06746 3/20 0.36
LMNA P02545 5/20 0.36
HSD17B10 Q99714 3/20 0.36
MAPK1 P28482 2/20 0.36
NPSR1 Q6W5P4 3/20 0.36
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
GAA P10253 2/20 0.36
USP2 O75604 1/20 0.35
HTT P42858 1/20 0.35
PIM1 P11309 1/20 0.34
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34

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
SCHEMBL23380634 0.96 KDM4E (0.37) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL23380635 0.96 KDM4E (0.37) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL20030271 0.95 ALDH1A1 (0.38) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL20030032 0.95 ALDH1A1 (0.39) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL20024223 0.94 ALDH1A1 (0.39) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL22006918 0.94 ALDH1A1 (0.39) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL17087617 0.94 TSHR (0.41) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL20029899 0.94 ALDH1A1 (0.39) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL23380241 0.93 KDM4E (0.38) ALDH1A1TSHRHPGDMAPTKDM4E
SCHEMBL24388280 0.93 PIM1 (0.39) ALDH1A1TSHRHPGDMAPTKDM4E

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-20190044071-A1 CARBAZOLES WITH TWO DIBENZOFURAN OR DIBENZOTHIOPHENE SUBSTITUENTS MERCK PATENT GMBH (DE) 2019-02-07 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-20190044071-A1 CARBAZOLES WITH TWO DIBENZOFURAN OR DIBENZOTHIOPHENE SUBSTITUENTS BRD3, BRPF3, DDT ALDH1A1 610/4885TSHR 3778/4885HPGD 2763/4885

“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.