SCHEMBL7188679

SCHEMBL7188679

O=C(Nc1ccccc1)c1cccc(C(=O)Nc2ccccc2)c1C(=O)Nc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.68
▸ MEN1 O00255 7/20 0.66
▸ KMT2A Q03164 7/20 0.66
▸ HPGD P15428 2/20 0.66
▸ KDM4E B2RXH2 1/20 0.66
▸ LMNA P02545 1/20 0.66
▸ TP53 P04637 1/20 0.66
▸ HTT P42858 1/20 0.66
▸ HSD17B10 Q99714 1/20 0.66
▸ TDP1 Q9NUW8 3/20 0.63
▸ METAP2 P50579 1/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ ALOX12 P18054 1/20 0.61
▸ CHRNB2 P17787 1/20 0.61
▸ CHRNB4 P30926 1/20 0.61
▸ CHRNA3 P32297 1/20 0.61
▸ CHRNA4 P43681 1/20 0.61
▸ GAA P10253 1/20 0.60
▸ BCAT2 O15382 2/20 0.58

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
SCHEMBL27987531 0.88 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL3791414 0.87 SMO (0.61) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL437231 0.87 ALDH1A1 (0.87) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL6841680 0.86 ALDH1A1 (0.72) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL11266259 0.85 ALDH1A1 (0.83) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL11266257 0.85 ALDH1A1 (0.83) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL3790280 0.84 HPGD (0.56) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL7067826 0.83 MEN1 (0.71) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL7183238 0.82 RAB9A (0.67) ALDH1A1MEN1KMT2AHPGDKDM4E
SCHEMBL3478178 0.82 ALDH1A1 (0.61) ALDH1A1MEN1KMT2AHPGDKDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1366116-A2 POLYPROPYLENE RESIN COMPOSITIONS Ciba SC Holding AG (CH) 2003-12-03 — — EP disclosed
WO-2002046300-A2 POLYPROPYLENE RESIN COMPOSITIONS CIBA SPECIALITY CHEMICALS HOLDING INC. (CH) 2002-06-13 — — WO disclosed
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