SCHEMBL21874451

SCHEMBL21874451

COC(=O)c1sc2c(Br)cccc2c1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COMT P21964 1/20 0.45
LMNA P02545 2/20 0.43
MAPK1 P28482 2/20 0.43
KMT2A Q03164 6/20 0.42
KDM4E B2RXH2 5/20 0.42
MAPT P10636 4/20 0.42
MEN1 O00255 4/20 0.42
HPGD P15428 3/20 0.42
ALDH1A1 P00352 2/20 0.42
ALOX15 P16050 2/20 0.42
HSD17B10 Q99714 2/20 0.42
GAA P10253 2/20 0.42
GLA P06280 1/20 0.42
ATM Q13315 1/20 0.42
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
POLB P06746 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL21874522 0.85 ALDH1A1 (0.45) LMNAMAPK1KMT2AKDM4EMAPT
SCHEMBL31490811 0.85 ALDH1A1 (0.45) LMNAMAPK1KMT2AKDM4EMAPT
SCHEMBL17204739 0.84 LMNA (0.44) LMNAMAPK1KMT2AKDM4EMAPT
SCHEMBL21874471 0.82 KDM4E (0.60) LMNAMAPK1KMT2AKDM4EMAPT
SCHEMBL21874462 0.82 LMNA (0.43) LMNAMAPK1KMT2AKDM4EMAPT
SCHEMBL21874508 0.81 MCL1 (0.56) MAPK1HDAC1HDAC8HDAC6
SCHEMBL21950022 0.77 HDAC1 (0.33) ALDH1A1HDAC1HDAC8HDAC6CASP3
SCHEMBL31370875 0.77 PFKFB3 (0.46) LMNAMAPK1KMT2AKDM4EMAPT
SCHEMBL4386528 0.75 LMNA (0.69) LMNAMAPK1KMT2AKDM4EMAPT
SCHEMBL9920686 0.75 MAPT (0.44) COMTLMNAMAPK1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435068-B2 Anthelmintic compounds ELANCO ANIMAL HEALTH GMBH (DE) 2025-10-07 US disclosed
CN-119409690-A Novel insect repellent compound 拜耳动物保健有限责任公司 2025-02-11 CN disclosed
US-20210380566-A1 NEW ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2021-12-09 US disclosed
US-20210380566-A1 NEW ANTHELMINTIC COMPOUNDS ELANCO ANIMAL HEALTH GMBH (DE) 2021-12-09 US disclosed
CN-113166123-A Novel insect repellent compounds 拜耳动物保健有限责任公司 2021-07-23 CN disclosed
EP-3847168-A2 NEW ANTHELMINTIC COMPOUNDS Bayer Animal Health GmbH (DE) 2021-07-14 EP disclosed
EP-3643711-A1 NEW ANTHELMINTIC COMPOUNDS Bayer Animal Health GmbH (DE) 2020-04-29 EP disclosed
EP-3643711-A1 NEW ANTHELMINTIC COMPOUNDS Bayer Animal Health GmbH (DE) 2020-04-29 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 (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-12435068-B2 Anthelmintic compounds H1-10, HRH2, HRH1 COMT 3392/4885LMNA 1634/4885MAPK1 3727/4885
US-20210380566-A1 NEW ANTHELMINTIC COMPOUNDS H1-10, HRH2, HRH4 COMT 3570/4885LMNA 1689/4885MAPK1 3604/4885

“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.