SCHEMBL6035645

SCHEMBL6035645

CC(=O)N[C@@H](C)C(=O)Nc1cccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.60
NPSR1 Q6W5P4 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
POLB P06746 2/20 0.56
ANPEP P15144 1/20 0.54
KDM4E B2RXH2 4/20 0.54
GAA P10253 2/20 0.54
MAPT P10636 2/20 0.53
RAB9A P51151 3/20 0.52
KMT2A Q03164 2/20 0.52
EPHX1 P07099 1/20 0.51
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
CYP2C19 P33261 2/20 0.50
NPC1 O15118 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.49
GSK3B P49841 1/20 0.49

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
SCHEMBL25342805 0.88 KDM4E (0.56) HSD17B10NPSR1SMN1; SMN2POLBANPEP
SCHEMBL25342801 0.88 KDM4E (0.56) HSD17B10NPSR1SMN1; SMN2POLBANPEP
SCHEMBL7448781 0.85 KDM4E (0.55) HSD17B10NPSR1SMN1; SMN2POLBANPEP
SCHEMBL21974647 0.84 RAB9A (0.57) NPSR1SMN1; SMN2POLBANPEPKDM4E
Hydrochloric Acid SCHEMBL8740055 0.84 KDM4E (0.54) HSD17B10NPSR1SMN1; SMN2POLBANPEP
SCHEMBL171696 0.82 KDM4E (0.62) NPSR1SMN1; SMN2POLBANPEPKDM4E
SCHEMBL29481043 0.81 ALDH1A1 (0.49) HSD17B10NPSR1SMN1; SMN2ANPEPKDM4E
SCHEMBL29514721 0.80 KDM4E (0.69) POLBKDM4EGAAMAPTRAB9A
SCHEMBL357522 0.80 KDM4E (0.69) POLBKDM4EGAAMAPTRAB9A
SCHEMBL18602340 0.80 KDM4E (0.59) NPSR1SMN1; SMN2POLBANPEPKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0759066-B1 PROCESS FOR OBTAINING MICRO-ORGANISMS CONTAINING PEPTIDE AMIDASE, MICRO-ORGANISMS OBTAINED THEREWITH, PEPTIDE AMIDASES CONTAINED IN THEM AND USE THEREOF DEGUSSA (DE) 2001-06-27 EP claimed
EP-0759066-A1 PROCESS FOR OBTAINING MICRO-ORGANISMS CONTAINING PEPTIDE AMIDASE, MICRO-ORGANISMS OBTAINED THEREWITH, PEPTIDE AMIDASES CONTAINED IN THEM AND USE THEREOF Degussa Aktiengesellschaft (DE) 1997-02-26 EP claimed
WO-1995030740-A1 PROCESS FOR OBTAINING MICRO-ORGANISMS CONTAINING PEPTIDE AMIDASE, MICRO-ORGANISMS OBTAINED THEREWITH, PEPTIDE AMIDASES CONTAINED IN THEM AND USE THEREOF DEGUSSA AKTIENGESELLSCHAFT (DE) 1995-11-16 WO claimed
US-20060259993-A1 Amidases, nucleic acids encoding them and methods for making and using them DIVERSA CORPORATION 2006-11-16 US disclosed
EP-1576102-A2 AMIDASES, NUCLEIC ACIDS ENCODING THEM AND METHODS FOR MAKING AND USING THEM DIVERSA CORPORATION (US) 2005-09-21 EP disclosed
WO-2004069848-A2 AMIDASES, NUCLEIC ACIDS ENCODING THEM AND METHODS FOR MAKING AND USING THEM DIVERSA CORPORATION (US) 2004-08-19 WO disclosed
US-20040023257-A1 Enzymes having secondary amidases activity and methods of use thereof DIVERSA CORPORATION (US) 2004-02-05 US disclosed
WO-2003064613-A2 AMIDASES, NUCLEIC ACIDS ENCODING THEM AND METHODS FOR MAKING AND USING THEM DIVERSA CORPORATION (US) 2003-08-07 WO disclosed
WO-2003027315-A2 AMIDASES, NUCLEIC ACIDS ENCODING THEM AND METHODS FOR MAKING AND USING THEM DIVERSA CORPORATION (US) 2003-04-03 WO disclosed
US-6333176-B1 ENZYMATIC CLEAVAGE OF C-TERMINAL AMINO GROUP FROM PEPTIDE AMIDE, DEAMINATION WITH PEPTIDE AMIDASE, INCUBATION AND INOCULATION DEGUSSA AKTIENGESELLSCHAFT (DE) 2001-12-25 US disclosed
EP-0759066-B1 PROCESS FOR OBTAINING MICRO-ORGANISMS CONTAINING PEPTIDE AMIDASE, MICRO-ORGANISMS OBTAINED THEREWITH, PEPTIDE AMIDASES CONTAINED IN THEM AND USE THEREOF DEGUSSA (DE) 2001-06-27 EP disclosed
US-5985632-A Peptide amidase from xanthomonas DEGUSSA AKTIENGESELLSCHAFT (DE) 1999-11-16 US disclosed