SCHEMBL9418296

SCHEMBL9418296

C[Si](C)(O[Si](C)(C)c1cccc(C(=O)O)c1)c1cccc(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA6 P23280 2/20 0.47
CA9 Q16790 2/20 0.47
AKR1C3 P42330 1/20 0.46
ACHE P22303 1/20 0.45
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
KMO O15229 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
KMT2A Q03164 2/20 0.44
UNG P13051 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
TPMT P51580 1/20 0.43
CA14 Q9ULX7 1/20 0.43
GAA P10253 2/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL8018938 0.82 ACHE (0.62) CA12CA1CA2CA6CA9
SCHEMBL14740775 0.81 CA12 (0.50) CA12CA1CA2CA6CA9
Hydrochloric Acid SCHEMBL10926742 0.81 ACHE (0.61) CA12CA1CA2CA6CA9
SCHEMBL28678908 0.78 CA12 (0.56) CA12CA1CA2CA6CA9
SCHEMBL2786186 0.76 HPGD (0.65) CA12CA1CA2CA6CA9
SCHEMBL10476991 0.75 KMO (0.53) CA12CA1CA2CA6CA9
SCHEMBL14880008 0.74 CA12 (0.47) CA12CA1CA2CA6CA9
SCHEMBL20383105 0.74 AKR1B1 (0.47) AKR1C3HPGDHSD17B10CYP1A2KMT2A
Isophthalic Acid SCHEMBL29023597 0.73 CA12 (0.60) CA12CA1CA2CA6CA9
Isophthalic Acid SCHEMBL30529662 0.73 CA12 (0.65) CA12CA1CA2CA6CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0386549-B1 Aromatic polyester-siloxane block copolymers and method for making GEN ELECTRIC (US) 1994-02-09 EP disclosed
EP-0386549-A2 Aromatic polyester-siloxane block copolymers and method for making GENERAL ELECTRIC COMPANY (US) 1990-09-12 EP disclosed
US-4945147-A MOLDING MATERIALS, FIREPROOF GENERAL ELECTRIC COMPANY (US) 1990-07-31 US disclosed