SCHEMBL21361903

SCHEMBL21361903

CCCCCC(CCC)CCN1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.40
LMNA P02545 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
GNAI3 P08754 2/20 0.36
GNAO1 P09471 2/20 0.36
GNAI1 P63096 2/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.34
BCHE P06276 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
PRMT8 Q9NR22 1/20 0.33

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
SCHEMBL21392491 0.94 LTA4H (0.45) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL19185581 0.94 LTA4H (0.45) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL19185641 0.94 LTA4H (0.45) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL19185652 0.94 LTA4H (0.45) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL21361983 0.94 HRH3 (0.38) LTA4HHRH3GNAI3GNAO1GNAI1
SCHEMBL22857557 0.92 HRH3 (0.46) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL19185680 0.92 LTA4H (0.44) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL22857504 0.91 HRH3 (0.45) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL25064562 0.90 LMNA (0.43) LTA4HLMNAHRH3GNAI3GNAO1
SCHEMBL21725456 0.90 HRH3 (0.41) LTA4HHRH3GNAI3GNAO1GNAI1

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
US-10736881-B2 Benzimidazole derivatives: preparation and pharmaceutical applications MEI PHARMA, INC. (US) 2020-08-11 US disclosed
US-20190282547-A1 BENZIMIDAZOLE DERIVATIVES: PREPARATION AND PHARMACEUTICAL APPLICATIONS S*BIO PTE LTD. (SG) 2019-09-19 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 (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-20190282547-A1 BENZIMIDAZOLE DERIVATIVES: PREPARATION AND PHARMACEUTICAL APPLICATIONS HDAC5, HDAC1, HDAC8 LTA4H 2291/4885LMNA 978/4885HRH3 177/4885
US-10736881-B2 Benzimidazole derivatives: preparation and pharmaceutical applications HDAC5, HDAC1, HDAC8 LTA4H 2291/4885LMNA 978/4885HRH3 177/4885

“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.