SCHEMBL10339294

SCHEMBL10339294

O=C(NO)C(Cl)(Cl)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 6/20 0.59
HDAC6 Q9UBN7 6/20 0.59
HDAC1 Q13547 6/20 0.59
HDAC3 O15379 5/20 0.59
HDAC7 Q8WUI4 5/20 0.59
HDAC2 Q92769 5/20 0.59
HDAC4 P56524 4/20 0.59
HDAC10 Q969S8 4/20 0.59
HDAC11 Q96DB2 4/20 0.59
HDAC9 Q9UKV0 4/20 0.59
HDAC5 Q9UQL6 4/20 0.59
CYP1A2 P05177 1/20 0.50
TSHR P16473 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
IDO1 P14902 1/20 0.41
ALOX15 P16050 1/20 0.41
CA9 Q16790 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NCOR2 Q9Y618 1/20 0.41

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
SCHEMBL8837910 0.83 CYP1A2 (0.50) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL17513416 0.81 CYP1A2 (0.48) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL4524605 0.77 HDAC8 (0.63) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL7987418 0.77 CYP1A2 (0.58) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL2547243 0.77 CYP1A2 (0.65) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL11184461 0.76 CYP1A2 (0.44) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL2845025 0.76 HDAC3 (0.61) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL6789914 0.76 HDAC8 (0.61) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL3086830 0.75 CYP1A2 (0.56) HDAC8HDAC6HDAC1HDAC3HDAC7
SCHEMBL8818467 0.75 CYP1A2 (0.56) HDAC8HDAC6HDAC1HDAC3HDAC7

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
JP-2194019-A None JP disclosed
JP-H02194019-A FLAME-RESISTANT POLYCARBONATE AND ITS PRODUCTION ENICHEM TECNORESINE SPA 1990-07-31 JP disclosed