SCHEMBL7693622

SCHEMBL7693622

C[Si]1(C)CC[Si](C)(C)N1c1nc2ccc(C(=O)O)cn2c1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 15/20 0.48
▸ AKT2 P31751 15/20 0.48
▸ F2RL1 P55085 1/20 0.41
▸ ALPG P10696 1/20 0.39
▸ AKR1B1 P15121 1/20 0.39
▸ TOP2A P11388 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL25391 0.77 F2RL1 (0.58) AKT1AKT2F2RL1ALPGAKR1B1
SCHEMBL7467961 0.74 AKT1 (0.56) AKT1AKT2F2RL1AKR1B1
SCHEMBL11245977 0.67 AKR1B1 (0.71) ALPGAKR1B1RXFP1
SCHEMBL21500652 0.67 F2RL1 (0.56) AKT1AKT2F2RL1
SCHEMBL361086 0.65 AKT1 (1.00) AKT1AKT2
SCHEMBL15050025 0.65 AKT1 (0.58) AKT1AKT2F2RL1
SCHEMBL15071152 0.65 F2RL1 (0.75) F2RL1
Hydrochloric Acid SCHEMBL360472 0.65 AKT1 (0.98) AKT1AKT2
SCHEMBL5348158 0.64 AKT1 (0.60) AKT1AKT2
SCHEMBL7683359 0.64 CDK2 (0.59) AKT1AKT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6358971-B1 FOR INHIBITING THE GROWTH OF A PICORNAVIRUS ELI LILLY AND COMPANY 2002-03-19 — — US disclosed
Send feedback