SCHEMBL5929296

SCHEMBL5929296

CCCc1ccc(-c2nc(-c3c(CC)cccc3CC)n(CC)c2CN2CCCCC2c2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CFB P00751 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ HTT P42858 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ TSHR P16473 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.32
▸ OPRM1 P35372 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ AGTR1 P30556 1/20 0.32
▸ AGTR2 P50052 1/20 0.32
▸ CD274 Q9NZQ7 1/20 0.32

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
SCHEMBL5929019 0.95 GAA (0.35) GAAKMT2ACFBNPSR1KDM4E
SCHEMBL5929363 0.92 KMT2A (0.39) GAAKMT2ACFBKDM4EALDH1A1
SCHEMBL5929141 0.91 KMT2A (0.38) GAAKMT2ACFBKDM4EALDH1A1
SCHEMBL5929038 0.90 DRD2 (0.40) GAAKMT2ACFBKDM4EALDH1A1
SCHEMBL5928984 0.90 ALDH1A1 (0.41) GAAKMT2ACFBKDM4EALDH1A1
SCHEMBL5929078 0.88 KCNK3 (0.37) GAAKMT2ACFBKDM4EALDH1A1
SCHEMBL5929122 0.88 KMT2A (0.41) GAAKMT2AKDM4EALDH1A1MAPT
SCHEMBL5929090 0.88 KDM4E (0.38) GAAKMT2ACFBKDM4EALDH1A1
SCHEMBL5928924 0.87 KMT2A (0.37) GAAKMT2ACFBNPSR1KDM4E
SCHEMBL5929034 0.87 CFB (0.37) GAAKMT2ACFBNPSR1KDM4E

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 GAA 4885/4885KMT2A 2955/4885CFB 26/4885

“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.

Send feedback