SCHEMBL4935278

SCHEMBL4935278

Cc1c(N2CCCC(C)C2)cnc2ncn(C)c12

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ MAPT P10636 4/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ GRM4 Q14833 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ TP53 P04637 4/20 0.35
▸ CDK8 P49336 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ LRRK2 Q5S007 3/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ PRKDC P78527 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
SCHEMBL4932197 0.80 KDM4E (0.37) KDM4EHTTMAPTNPC1RAB9A
SCHEMBL27366298 0.76 JAK3 (0.50) KDM4EMAPTNPC1RAB9AGRM4
SCHEMBL27274962 0.68 KDM4E (0.45) KDM4EHTTMAPTNPC1RAB9A
SCHEMBL21981199 0.66 JAK3 (0.47) KDM4EMAPTNPC1RAB9AGRM4
SCHEMBL22118361 0.66 JAK3 (0.47) KDM4EMAPTNPC1RAB9AGRM4
SCHEMBL14325245 0.65 GRM4 (0.45) KDM4EHTTMAPTNPC1RAB9A
SCHEMBL27404283 0.65 CCR1 (0.34) MAPT
SCHEMBL10136907 0.64 ADRA1A (0.46) KDM4EHTTMAPTNPC1RAB9A
SCHEMBL12697233 0.63 NPC1 (0.45) KDM4EHTTMAPTNPC1RAB9A
SCHEMBL31068648 0.63 HRH4 (0.41) —

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-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS PFIZER INC. 2008-12-18 — — 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-20080312271-A1 AZABENZIMIDAZOLYL COMPOUNDS AZI2, PAICS, UGT2B7 KDM4E 793/4885HTT 3033/4885MAPT 3948/4885

“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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