SCHEMBL11884053

SCHEMBL11884053

CCOC1(c2ccccc2)c2cc(Cl)ccc2NC(=O)N1C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 5/20 0.46
▸ IDO1 P14902 2/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ ADCY8 P40145 1/20 0.36
▸ HTR7 P34969 4/20 0.36
▸ TP53 P04637 1/20 0.35
▸ MDM2 Q00987 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PGR P06401 2/20 0.35
▸ MGAM O43451 1/20 0.34
▸ HTR1A P08908 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ SI P14410 1/20 0.34
▸ HTR2A P28223 1/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ MGAM2 Q2M2H8 1/20 0.34

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
SCHEMBL11390102 0.86 MEN1 (0.39) AKR1B1IDO1MEN1KMT2AMAPT
SCHEMBL9539722 0.80 AKR1B1 (0.50) AKR1B1IDO1MAPTBRD4HTR7
SCHEMBL9539047 0.78 AKR1B1 (0.48) AKR1B1IDO1MAPTBRD4HTR7
SCHEMBL9541565 0.76 AKR1B1 (0.51) AKR1B1IDO1MEN1KMT2AMAPT
SCHEMBL9539767 0.72 AKR1B1 (0.48) AKR1B1IDO1MEN1KMT2AMAPT
SCHEMBL9539996 0.72 AKR1B1 (0.48) AKR1B1IDO1MEN1KMT2AMAPT
SCHEMBL9571341 0.72 AKR1B1 (0.45) AKR1B1IDO1MEN1KMT2AMAPT
SCHEMBL9539756 0.72 AKR1B1 (0.56) AKR1B1IDO1MEN1KMT2AHTR7
SCHEMBL11882562 0.72 MDM2 (0.54) AKR1B1IDO1MEN1KMT2AMDM2
SCHEMBL4594261 0.71 AKR1B1 (0.43) AKR1B1IDO1MEN1KMT2AMAPT

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-3865827-A Process for producing quanazolinone derivatives SUMIMATO CHEMICAL COMPANY LIMI 1975-02-11 — — US disclosed
Send feedback