SCHEMBL4185334

SCHEMBL4185334

Cc1cccc2c(=O)oc(-c3cccc4ccccc34)nc12

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 0.60
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NPC1 O15118 1/20 0.48
MAPT P10636 1/20 0.48
F7 P08709 1/20 0.48
F3 P13726 1/20 0.48
C1R P00736 2/20 0.48
F2 P00734 1/20 0.46
PKM P14618 1/20 0.45
KLK3 P07288 1/20 0.45

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
SCHEMBL16431272 0.87 C1R (0.65) ELANEMEN1KMT2ANPC1MAPT
SCHEMBL25054223 0.86 C1R (0.63) ELANEMEN1KMT2ANPC1MAPT
SCHEMBL5257723 0.82 C1R (0.58) ELANEMEN1KMT2AMAPTC1R
SCHEMBL4197820 0.82 C1R (0.61) ELANEMEN1KMT2ANPC1MAPT
SCHEMBL5921486 0.81 PKM (0.57) ELANEMEN1KMT2ANPC1MAPT
SCHEMBL9985296 0.80 ELANE (0.64) ELANEMEN1KMT2ANPC1MAPT
SCHEMBL4192197 0.80 C1R (0.71) ELANEC1R
SCHEMBL2816912 0.78 C1R (0.69) ELANEMEN1KMT2ANPC1MAPT
SCHEMBL4194659 0.76 C1R (0.72) ELANEMEN1KMT2ANPC1C1R
SCHEMBL1095684 0.76 ELANE (1.00) ELANEMEN1KMT2A

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-1756044-A1 THERAPEUTIC COMPOUNDS AstraZeneca AB (SE) 2007-02-28 EP disclosed
WO-2005115972-A1 THERAPEUTIC COMPOUNDS ASTRAZENECA AB (SE) 2005-12-08 WO disclosed