SCHEMBL5929101

SCHEMBL5929101

CCc1cccc(CC)c1-c1nc(-c2ccccc2)c(CN2CCCCC2c2ccc3c(c2)OCO3)s1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 3/20 0.42
▸ ACHE P22303 2/20 0.41
▸ POLB P06746 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GPR35 Q9HC97 1/20 0.40
▸ CPT2 P23786 1/20 0.38
▸ CPT1A P50416 1/20 0.38
▸ BCHE P06276 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ ABCB1 P08183 1/20 0.36
▸ ABCG2 Q9UNQ0 1/20 0.36
▸ FAAH O00519 1/20 0.36

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
SCHEMBL5928988 0.96 POLB (0.42) TERTACHEPOLBALDH1A1KMT2A
SCHEMBL5929039 0.88 MAPT (0.40) TERTALDH1A1KMT2ANPC1LMNA
SCHEMBL5929049 0.83 POLB (0.41) TERTACHEPOLBALDH1A1KMT2A
SCHEMBL5929070 0.82 KMT2A (0.41) TERTACHEPOLBALDH1A1KMT2A
SCHEMBL5929123 0.81 POLB (0.40) TERTACHEPOLBALDH1A1KMT2A
SCHEMBL5929306 0.79 C5AR1 (0.44) TERTACHEPOLBALDH1A1KMT2A
SCHEMBL5929104 0.79 CPT2 (0.38) TERTPOLBALDH1A1KMT2AMEN1
SCHEMBL5928927 0.74 KMT2A (0.41) TERTPOLBALDH1A1KMT2AMEN1
SCHEMBL5929028 0.73 C5AR1 (0.52) TERTACHEPOLBALDH1A1KMT2A
SCHEMBL5929189 0.70 KMT2A (0.36) TERTALDH1A1KMT2ALMNABCHE

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 TERT 4563/4885ACHE 3648/4885POLB 4751/4885

“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