SCHEMBL10037348

SCHEMBL10037348

O=C(c1ccc(-c2ccc(-c3sc(-c4ccc(-c5ccc(C(=O)C(F)(F)F)cc5)s4)c4c3C(=O)C(F)(F)C4=O)s2)cc1)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 10/20 0.47
HDAC1 Q13547 6/20 0.47
CES1 P23141 1/20 0.36
PRF1 P14222 2/20 0.33
MLYCD O95822 3/20 0.33
NQO2 P16083 1/20 0.33
HDAC4 P56524 2/20 0.32

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
SCHEMBL10037356 0.95 HDAC6 (0.41) HDAC6HDAC1CES1MLYCDHDAC4
SCHEMBL10037349 0.84 PRF1 (0.44) HDAC6HDAC1PRF1NQO2
SCHEMBL10037347 0.84 HDAC6 (0.48) HDAC6HDAC1PRF1NQO2
SCHEMBL10037351 0.81 HDAC6 (0.51) HDAC6HDAC1HDAC4
SCHEMBL12973037 0.80 HDAC6 (0.63) HDAC6HDAC1CES1MLYCDNQO2
SCHEMBL10037355 0.78 HDAC6 (0.42) HDAC6PRF1NQO2
SCHEMBL10037345 0.77 HSD17B1 (0.40) HDAC6HDAC1NQO2
SCHEMBL13620098 0.75 HDAC6 (0.37) HDAC6HDAC1CES1MLYCD
SCHEMBL12993232 0.73 HDAC6 (0.75) HDAC6HDAC1CES1PRF1MLYCD
SCHEMBL10037354 0.71 PTP4A3 (0.33) HDAC6HDAC1NQO2

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
US-8114956-B2 Polymer having unit obtained by condensation of difluorocyclopentanedione ring and aromatic ring, organic thin film using the same, and organic thin film device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-14 US disclosed
US-20100084640-A1 POLYMER HAVING UNIT OBTAINED BY CONDENSATION OF DIFLUOROCYCLOPENTANEDIONE RING AND AROMATIC RING, ORGANIC THIN FILM USING THE SAME, AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
US-20100084640-A1 POLYMER HAVING UNIT OBTAINED BY CONDENSATION OF DIFLUOROCYCLOPENTANEDIONE RING AND AROMATIC RING, ORGANIC THIN FILM USING THE SAME, AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed