SCHEMBL22436739

SCHEMBL22436739

CCc1c(Br)c(C(=O)CCN(C)C)nn1C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRA P10827 6/20 0.33
L3MBTL4 Q8NA19 1/20 0.32
THRB P10828 5/20 0.32
GSR P00390 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CDC25B P30305 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
SCHEMBL22436678 0.76 THRA (0.38) THRATHRB
SCHEMBL22437490 0.76 NPC1 (0.31) LMNASMN1; SMN2
SCHEMBL22436736 0.76 HCAR2 (0.37) LMNASMN1; SMN2
SCHEMBL22436699 0.74 LMNA (0.32) LMNASMN1; SMN2
SCHEMBL22436659 0.74 HTR2A (0.31) LMNA
SCHEMBL22436689 0.74 KMT2A (0.47) THRATHRBLMNASMN1; SMN2
SCHEMBL22436758 0.74 HTR2A (0.31) SMN1; SMN2
SCHEMBL22436781 0.73 SMN1; SMN2 (0.36) LMNASMN1; SMN2
SCHEMBL22436665 0.72 GAA (0.39) LMNASMN1; SMN2
SCHEMBL19635556 0.72

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-11891404-B2 Substituted macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2024-02-06 US disclosed
CN-111757884-B Substituted macrocyclic indole derivatives 拜耳股份公司 2023-12-19 CN disclosed
US-20230112244-A1 SUBSTITUTED MACROCYCLIC INDOLE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed
US-11440923-B2 Substituted macrocyclic indole derivatives BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-09-13 US disclosed
US-11440923-B2 Substituted macrocyclic indole derivatives BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-09-13 US disclosed
CN-111757884-A Substituted macrocyclic indole derivatives 拜耳股份公司 2020-10-09 CN disclosed
EP-3710451-A1 SUBSTITUTED MACROCYCLIC INDOLE DERIVATIVES Bayer Aktiengesellschaft (DE) 2020-09-23 EP 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-20230112244-A1 SUBSTITUTED MACROCYCLIC INDOLE DERIVATIVES FOXM1, CCND2, CCNI THRA 618/4885L3MBTL4 1912/4885THRB 922/4885
US-11891404-B2 Substituted macrocyclic indole derivatives FOXM1, CCND2, CCNI THRA 618/4885L3MBTL4 1912/4885THRB 922/4885
US-11440923-B2 Substituted macrocyclic indole derivatives FOXM1, CCND2, CCNI THRA 618/4885L3MBTL4 1912/4885THRB 922/4885

“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.