SCHEMBL5929241

SCHEMBL5929241

CCc1cccc(CC)c1-c1nc(-c2ccc(Cl)cc2C)c(CN2CCCCC2c2ccccc2)n1CC

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CFB P00751 4/20 0.38
▸ CRHR1 P34998 1/20 0.36
▸ KMT2A Q03164 2/20 0.35
▸ DRD2 P14416 6/20 0.34
▸ DRD3 P35462 6/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ P2RX7 Q99572 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
SCHEMBL5929208 0.90 LMNA (0.40) KDM4EALDH1A1GAACFBKMT2A
SCHEMBL5929076 0.90 CFB (0.41) KDM4EALDH1A1GAACFBKMT2A
SCHEMBL5928966 0.88 ALDH1A1 (0.42) KDM4EALDH1A1GAATSHRHTT
SCHEMBL5929212 0.88 KDM4E (0.44) KDM4EALDH1A1GAATSHRHTT
SCHEMBL5929038 0.88 DRD2 (0.40) KDM4EALDH1A1GAATSHRHTT
SCHEMBL5928973 0.88 KMT2A (0.39) KDM4EALDH1A1GAACFBKMT2A
SCHEMBL5929207 0.87 CFB (0.41) KDM4EALDH1A1GAACFBCRHR1
SCHEMBL5929204 0.85 LMNA (0.39) KDM4EALDH1A1GAACFBCRHR1
SCHEMBL5929105 0.85 LMNA (0.40) KDM4EALDH1A1GAACFBKMT2A
SCHEMBL5929008 0.85 LMNA (0.41) KDM4EALDH1A1GAACFBKMT2A

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 KDM4E 1762/4885ALDH1A1 3884/4885GAA 4885/4885

“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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