SCHEMBL19616038

SCHEMBL19616038

Cn1nc(CO)c(Br)c1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CSNK2A1 P68400 10/20 0.33
NPC1 O15118 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
IDO1 P14902 1/20 0.33
RAB9A P51151 1/20 0.32
CSNK2A2 P19784 3/20 0.32
CSNK2B P67870 2/20 0.32
CSNK2A3 Q8NEV1 2/20 0.32
KDM4E B2RXH2 1/20 0.31
HTT P42858 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
SCHEMBL6819929 0.85 MAPT (0.39) POLBMAPTTDP1L3MBTL1NPC1
SCHEMBL27898717 0.82 SMN1; SMN2 (0.47) POLBMAPTTDP1L3MBTL1NPC1
SCHEMBL29291196 0.80 POLB (0.35) POLBMAPTTDP1L3MBTL1NPC1
SCHEMBL19635177 0.78 KMT2A (0.41) POLBMAPTL3MBTL1NPC1SMN1; SMN2
SCHEMBL1359424 0.75 SMN1; SMN2 (0.49) POLBMAPTTDP1L3MBTL1NPC1
SCHEMBL19615335 0.74 MAPT (0.33) POLBMAPTTDP1L3MBTL1
Hydrochloric Acid SCHEMBL9151563 0.73 SMN1; SMN2 (0.48) POLBMAPTTDP1L3MBTL1NPC1
SCHEMBL4163341 0.72 CSNK2A1 (0.35) POLBCSNK2A1NPC1SMN1; SMN2IDO1
SCHEMBL15273661 0.71 HTR2C (0.38)
SCHEMBL1326752 0.70 KDM4E (0.51) POLBMAPTNPC1SMN1; SMN2KDM4E

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-11492358-B1 Macrocyclic indole derivatives THE BROAD INSTITUTE, INC. (US) 2022-11-08 US disclosed
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
CN-109715632-B Macrocyclic indole derivatives 拜尔公开股份有限公司 2021-10-26 CN disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-03-19 US disclosed
EP-3458459-A1 MACROCYCLIC INDOLE DERIVATIVES Bayer Aktiengesellschaft (DE) 2019-03-27 EP disclosed
WO-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 WO 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-11492358-B1 Macrocyclic indole derivatives CCND2, CCNT2, IDO1 POLB 2024/4885MAPT 2810/4885TDP1 1748/4885
US-10981932-B2 Macrocyclic indole derivatives CCND2, IDO1, CCNT2 POLB 2267/4885MAPT 2202/4885TDP1 2279/4885
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES CCND2, CCNA1, CCNT2 POLB 2027/4885MAPT 3026/4885TDP1 1836/4885

“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.