SCHEMBL5929125

SCHEMBL5929125

CCc1cccc(CC)c1-c1nc(Cl)c(CN2CCCCC2c2ccccc2)n1CCOC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CFB P00751 4/20 0.38
▸ CRHR1 P34998 1/20 0.36
▸ DRD2 P14416 5/20 0.36
▸ DRD3 P35462 5/20 0.36
▸ KDM4E B2RXH2 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ RAB9A P51151 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
SCHEMBL5928948 0.92 OPRK1 (0.40) GAAKMT2ADRD2DRD3KDM4E
SCHEMBL5928938 0.88 KMT2A (0.39) GAAKMT2ACFBDRD2DRD3
SCHEMBL5929248 0.86 KDM4E (0.33) KMT2AKDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL5928908 0.86 POLB (0.38) KMT2AKDM4EALDH1A1MAPTRAB9A
SCHEMBL5929054 0.85 ALDH1A1 (0.38) KMT2AKDM4EALDH1A1TSHRHTT
SCHEMBL5929068 0.85 ALDH1A1 (0.38) KMT2AKDM4EALDH1A1TSHRHTT
SCHEMBL5929216 0.84 OPRK1 (0.39) GAAKMT2ADRD2DRD3KDM4E
SCHEMBL5929191 0.83 KDM4E (0.52) KMT2AKDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL5929009 0.80 MDM2 (0.33) CFBKDM4EALDH1A1SMN1; SMN2
SCHEMBL5928949 0.80 KDM4E (0.49) GAAKMT2ACFBKDM4EALDH1A1

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.

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