SCHEMBL5929124

SCHEMBL5929124

CCc1cccc(CC)c1-c1nc(Br)c(CN2CCCCC2c2ccc3c(c2)OCCO3)n1CC1OCCO1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ LMNA P02545 2/20 0.35
▸ TERT O14746 4/20 0.34
▸ CD274 Q9NZQ7 4/20 0.34
▸ PDCD1 Q15116 3/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ NPSR1 Q6W5P4 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
SCHEMBL5929189 0.97 KMT2A (0.36) BCHELMNATERTKMT2AKDM4E
SCHEMBL5929012 0.92 POLB (0.38) BCHEPOLBLMNATERTCD274
SCHEMBL5928927 0.84 KMT2A (0.41) POLBLMNATERTKMT2AKDM4E
SCHEMBL5929230 0.82 POLB (0.39) BCHEPOLBLMNATERTCD274
SCHEMBL5928890 0.82 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL5929097 0.80 POLB (0.39) BCHEPOLBLMNATERTCD274
SCHEMBL5929107 0.79 KDM4E (0.39) BCHEPOLBLMNATERTCD274
SCHEMBL5928908 0.79 POLB (0.38) BCHEPOLBLMNACD274PDCD1
SCHEMBL5929061 0.77 POLB (0.39) POLBKMT2AKDM4EMEN1ALDH1A1
SCHEMBL5929223 0.76 CCNT1 (0.33) LMNAKMT2AKDM4EMEN1ALDH1A1

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-20060154917-A1 Substituted (heterocycloalkyl)methyl azole derivatives as c5a receptor modulators NEUROGEN CORPORATION (US) 2006-07-13 — — 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-20060154917-A1 Substituted (heterocycloalkyl)methyl azole derivatives as c5a receptor modulators C5AR1, C5AR2, C3AR1 BCHE 3023/4885POLB 4751/4885LMNA 4776/4885

“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.

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