SCHEMBL5929025

SCHEMBL5929025

CCCCn1c(-c2c(C)cccc2C)nc(Cl)c1CN1CCCCC1c1ccc(OC)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CFB P00751 5/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ KDM4E B2RXH2 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35

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
SCHEMBL5929004 0.92 KMT2A (0.39) CFBSMN1; SMN2ALDH1A1KDM4EMAPT
SCHEMBL5929023 0.92 CFB (0.43) CFBCYP3A4CYP2D6KCNH2
SCHEMBL5929140 0.91 SMN1; SMN2 (0.38) CFBSMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL5929015 0.90 CFB (0.50) CFBALDH1A1KDM4EMAPTRAB9A
SCHEMBL5929089 0.90 CFB (0.43) CFBALDH1A1KDM4EMAPTRAB9A
SCHEMBL5928878 0.89 CFB (0.43) CFBCYP3A4CYP2D6KCNH2
SCHEMBL5928941 0.89 KDM4E (0.39) CFBALDH1A1KDM4EMAPTRAB9A
SCHEMBL5929052 0.89 KDM4E (0.39) CFBALDH1A1KDM4EMAPTRAB9A
SCHEMBL5929301 0.89 KDM4E (0.39) CFBALDH1A1KDM4EMAPTRAB9A
SCHEMBL5929224 0.89 SMN1; SMN2 (0.40) CFBSMN1; SMN2ALDH1A1KDM4EMAPT

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 CFB 26/4885SMN1; SMN2 4708/4885ALDH1A1 3884/4885

“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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