SCHEMBL26807553

SCHEMBL26807553

CN1CCC(c2ccc(OC(=O)c3cc(I)cc(I)c3I)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.40
FAAH O00519 3/20 0.39
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
MAOA P21397 3/20 0.38
KDM1A O60341 2/20 0.38
KDM1B Q8NB78 2/20 0.38
RCOR1 Q9UKL0 2/20 0.38
MAOB P27338 2/20 0.36
PARP1 P09874 1/20 0.36
PARP2 Q9UGN5 1/20 0.36

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
SCHEMBL26426679 0.84 NAMPT (0.46) ALDH1A1
SCHEMBL26426678 0.83 QDPR (0.38) QDPRPARP1PARP2
SCHEMBL26427856 0.76 ATM (0.53)
SCHEMBL26426646 0.73 HTR4 (0.49) HDAC3HDAC1HDAC2DRD2
SCHEMBL28878805 0.73 QDPR (0.47) QDPRFAAHHDAC3HDAC4HDAC1
SCHEMBL26426656 0.73 HDAC6 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL22277451 0.72 ATM (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL21911755 0.72 MAPT (0.38) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL19678505 0.72 TPMT (0.43) ALDH1A1
SCHEMBL22277826 0.71 ATM (0.33) SLC6A2SLC6A4SLC6A3

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
US-11829067-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-28 US disclosed
US-11829067-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-28 US disclosed