SCHEMBL5326935

SCHEMBL5326935

COCCOC(C(N)=O)c1cc(-c2ccc(-c3ccc(C)c(C)c3)cc2)nn1C

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MALT1 Q9UDY8 1/20 0.35
▸ PHGDH O43175 5/20 0.34
▸ ALPL P05186 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ ESRRA P11474 1/20 0.34
▸ MAPT P10636 4/20 0.34
▸ TP53 P04637 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PPARG P37231 2/20 0.33
▸ PPARD Q03181 2/20 0.33
▸ PPARA Q07869 2/20 0.33
▸ ASIC1 P78348 1/20 0.32
▸ HTT P42858 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
SCHEMBL5326930 0.72 MAPT (0.43) POLBMEN1KMT2AMALT1MAPT
SCHEMBL5306917 0.71 PHGDH (0.43) PHGDHALPLCA9ESRRAMAPT
SCHEMBL5304367 0.70 ALDH1A1 (0.44) POLBMEN1KMT2AMALT1ESRRA
SCHEMBL5308125 0.68 ESRRA (0.43) ALPLCA9ESRRAMAPTTP53
SCHEMBL5306918 0.67 MAPT (0.46) MEN1KMT2AESRRAMAPTTP53
SCHEMBL5306910 0.66 ESRRA (0.36) PHGDHALPLCA9ESRRAMAPT
SCHEMBL5306317 0.65 MAPT (0.45) POLBMEN1KMT2AMAPTLMNA
SCHEMBL5306577 0.65 CYP11B1 (0.41) MEN1KMT2AALPLCA9ESRRA
SCHEMBL5301960 0.65 TSHR (0.55) POLBMEN1KMT2AMAPTLMNA
SCHEMBL5311060 0.65 MAPT (0.49) POLBMEN1KMT2AMAPTSMN1; SMN2

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
WO-2007034279-A2 C3A ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER PRODUCTS INC. (US) 2007-03-29 — — WO disclosed
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