SCHEMBL7002836

SCHEMBL7002836

Cn1ncc(N(Cc2ccccc2)C(=O)CCCl)c(Cl)c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
MAPT P10636 2/20 0.49
GAA P10253 1/20 0.49
PKM P14618 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KAT2B Q92831 7/20 0.46
BRD4 O60885 4/20 0.46
BRD9 Q9H8M2 3/20 0.46
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PTGS1 P23219 2/20 0.41
BPTF Q12830 4/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.39
HTT P42858 1/20 0.39
PAX8 Q06710 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6999530 0.77 KAT2B (0.48) RAB9ANPC1MAPTGAAPKM
SCHEMBL7001264 0.74 KAT2B (0.47) RAB9ANPC1MAPTGAAPKM
SCHEMBL7004455 0.68 ALDH1A1 (0.46) RAB9ANPC1MAPTGAAPKM
SCHEMBL10806799 0.67 KAT2B (0.59) RAB9AMAPTGAAPKMKAT2B
SCHEMBL10711762 0.66 MAPT (1.00) RAB9ANPC1MAPTGAAPKM
SCHEMBL6403389 0.66 RAB9A (0.79) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL7000441 0.65 KAT2B (0.43) RAB9ANPC1MAPTGAAPKM
SCHEMBL5460753 0.65 ALDH1A1 (0.54) RAB9ANPC1MEN1KMT2AALDH1A1
SCHEMBL2857154 0.63 KMT2A (0.55) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL11725968 0.63 KMT2A (0.68) RAB9ANPC1MAPTGAAPKM

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
US-6602865-B1 Pyridazino(4,5-b)(1,5)oxazepinone, -thiazepinone and -diazepinone compounds IVAX DRUG RESEARCH INSTITUTE, LTD. (HU) 2003-08-05 US disclosed
EP-1129097-B1 NOVEL TYPE CONDENSED PYRIDAZINONE COMPOUNDS GYOGYSZERKUTATO INTEZET (HU) 2003-01-29 EP disclosed