SCHEMBL9486995

SCHEMBL9486995

CCCCC(=O)NC(Cc1ccccc1)C(=O)OC

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 6/20 0.67
HDAC6 Q9UBN7 6/20 0.67
POLB P06746 2/20 0.64
BIRC2 Q13490 1/20 0.61
ATM Q13315 1/20 0.59
PSMB5 P28074 1/20 0.59
FAAH O00519 2/20 0.58

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
SCHEMBL9487001 1.00 HDAC1 (0.67) HDAC1HDAC6POLBBIRC2ATM
SCHEMBL9486035 0.96 HDAC1 (0.70) HDAC1HDAC6POLBBIRC2PSMB5
SCHEMBL9486027 0.96 HDAC1 (0.70) HDAC1HDAC6POLBBIRC2PSMB5
SCHEMBL28360891 0.95 HDAC1 (0.72) HDAC1HDAC6POLBBIRC2FAAH
SCHEMBL28357269 0.95 HDAC1 (0.72) HDAC1HDAC6POLBBIRC2FAAH
SCHEMBL2337758 0.95 HDAC1 (0.72) HDAC1HDAC6POLBBIRC2FAAH
SCHEMBL28360892 0.95 HDAC1 (0.72) HDAC1HDAC6POLBBIRC2FAAH
SCHEMBL18796574 0.95 HDAC1 (0.72) HDAC1HDAC6POLBBIRC2FAAH
SCHEMBL28357270 0.95 HDAC1 (0.72) HDAC1HDAC6POLBBIRC2FAAH
SCHEMBL28357094 0.95 HDAC1 (0.72) HDAC1HDAC6POLBBIRC2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107041139-A The derivative of sea hare proline sea hare isoleucine peptide 艾更斯司股份有限公司 2017-08-11 CN claimed
CN-106573956-A Auristatin derivatives and conjugates thereof 诺华股份有限公司 2017-04-19 CN disclosed
EP-0198397-B1 METHOD OF PRODUCING L-PHENYLALANINE KURARAY CO., LTD. (JP) 1993-01-07 EP disclosed
US-4743547-A PURITY, ENZYME HYDROLYSIS KURARAY CO., LTD. (JP) 1988-05-10 US disclosed
EP-0198397-A2 Method of producing L-phenylalanine KURARAY CO., LTD. (JP) 1986-10-22 EP disclosed