SCHEMBL10480461

SCHEMBL10480461

C=CCOC(=O)N1C(=O)N(c2ccc(/C(C)=N/O)cc2)C(=O)C1CCSC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 9/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
MAPT P10636 2/20 0.35
NPC1 O15118 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
FAAH O00519 3/20 0.33
MGLL Q99685 1/20 0.33
POLB P06746 1/20 0.30

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
SCHEMBL10480463 1.00 CA9 (0.39) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10480482 0.84 CA9 (0.43) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10480484 0.84 CA9 (0.43) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10480557 0.84 CA9 (0.41) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10480554 0.84 CA9 (0.41) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10480494 0.73 CA9 (0.41) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10480496 0.73 CA9 (0.41) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10742685 0.69 CA9 (0.48) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10742675 0.69 CA9 (0.48) CA9MEN1ALDH1A1KMT2ACA1
SCHEMBL10480521 0.63 CA9 (0.49) CA9MEN1ALDH1A1KMT2ACA1

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-4868061-A ADDITION POLYMERS, ULTRAVIOLET RADIATION STABILIZERS THE STANDARD OIL COMPANY (US) 1989-09-19 US disclosed