SCHEMBL11567837

SCHEMBL11567837

Cn1cc2c(c(C#N)c1=O)-c1ccccc1C2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ CYP2C9 P11712 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ BRD4 O60885 5/20 0.41
▸ USP8 P40818 1/20 0.40
▸ USP7 Q93009 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ CDC25B P30305 1/20 0.38
▸ GRM2 Q14416 1/20 0.37
▸ MAP3K5 Q99683 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ L3MBTL1 Q9Y468 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
SCHEMBL11563512 0.82 USP8 (0.38) ALDH1A1KDM4ESMN1; SMN2CYP2C9LMNA
SCHEMBL11565243 0.74 ALDH1A1 (0.44) ALDH1A1KDM4ESMN1; SMN2CYP2C9LMNA
SCHEMBL11564349 0.71 HSD17B10 (0.48) ALDH1A1KDM4ESMN1; SMN2CYP2C9LMNA
SCHEMBL11083395 0.69 MEN1 (0.56) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL295307 0.68 ALDH1A1 (0.49) ALDH1A1KDM4ESMN1; SMN2CYP2C9LMNA
SCHEMBL11564415 0.68 USP8 (0.42) ALDH1A1KDM4ECYP2C9USP8USP7
SCHEMBL12114202 0.67 ALDH1A1 (0.53) ALDH1A1KDM4ESMN1; SMN2CYP2C9LMNA
SCHEMBL11560283 0.67 PDE9A (0.41) ALDH1A1KDM4ECYP2C9GLAGAA
Methane SCHEMBL28696439 0.66 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2CYP2C9LMNA
Methane SCHEMBL4141657 0.66 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2CYP2C9LMNA

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-4180666-A 3,9-Dihydro-3,9-dioxo-2H-indeno(2,1-c)-pyridine-4-(carbonitriles/carboxamides) G. D. SEARLE & CO. (US) 1979-12-25 — — US disclosed
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