SCHEMBL13811867

SCHEMBL13811867

O=C1N[C@@H](c2cccc(C(=O)O)c2)[C@H](c2cccc(C(=O)O)c2)N1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.51
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA6 P23280 1/20 0.46
CA9 Q16790 1/20 0.46
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
UNG P13051 1/20 0.42
FOLH1 Q04609 1/20 0.41
AKR1C3 P42330 1/20 0.41
DAO P14920 1/20 0.40
TSHR P16473 1/20 0.40
NAPRT Q6XQN6 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL4406076 1.00 KMO (0.51) KMOCA12CA1CA2CA6
SCHEMBL4406081 0.80 LOXL2 (0.46) CA12CA1CA2CA9TSHR
SCHEMBL2724029 0.74 SMN1; SMN2 (0.52) CA2CYP1A2HPGDHSD17B10KDM4E
SCHEMBL1633310 0.72 KMO (0.71) KMO
SCHEMBL30281246 0.72 KMO (0.83) KMOCA12CA1CA2CA6
SCHEMBL1543703 0.72 KMO (0.83) KMOCA12CA1CA2CA6
Hydrochloric Acid SCHEMBL6709116 0.71 KMO (0.69) KMO
Isophthalic Acid SCHEMBL22462 0.71 CA12 (0.71) KMOCA12CA1CA2CA6
Isophthalic Acid SCHEMBL20500514 0.71 CA12 (0.71) KMOCA12CA1CA2CA6
Isophthalic Acid SCHEMBL28462260 0.71 CA12 (0.71) KMOCA12CA1CA2CA6

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-7553809-B2 Fc receptor modulators and uses thereof ILEXUS PTY LIMITED (AU) 2009-06-30 US disclosed
US-7553809-B2 Fc receptor modulators and uses thereof ILEXUS PTY LIMITED (AU) 2009-06-30 US disclosed