SCHEMBL9737467

SCHEMBL9737467

COCCCCC(=O)[C@H]1[C@H](CSC(C)=O)N(Cc2ccccc2)C(=O)N1Cc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.35
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 3/20 0.33
POLA1 P09884 2/20 0.33
ALDH1A1 P00352 2/20 0.33
ALOX15 P16050 1/20 0.33
FPR1 P21462 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
HPGD P15428 2/20 0.32
ATM Q13315 2/20 0.32
MAPK10 P53779 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HDAC6 Q9UBN7 2/20 0.32
GAA P10253 1/20 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
SCHEMBL10667584 0.85 EHMT2 (0.38) EHMT2LMNAKDM4EMEN1KMT2A
SCHEMBL9679059 0.85 EHMT2 (0.38) EHMT2LMNAKDM4EMEN1KMT2A
SCHEMBL9736566 0.81 EHMT2 (0.41) EHMT2LMNAKDM4EMEN1KMT2A
SCHEMBL9736877 0.81 EHMT2 (0.41) EHMT2LMNAKDM4EMEN1KMT2A
SCHEMBL9845295 0.73 MEN1 (0.42) EHMT2LMNAKDM4EMEN1KMT2A
SCHEMBL9032586 0.73 MEN1 (0.42) EHMT2LMNAKDM4EMEN1KMT2A
SCHEMBL9679618 0.72 EHMT2 (0.42) EHMT2KDM4EMEN1KMT2APOLB
SCHEMBL9845296 0.71 MEN1 (0.39) EHMT2LMNAKDM4EMEN1KMT2A
SCHEMBL6049147 0.67 ALDH1A1 (0.53) EHMT2MEN1KMT2APOLBPOLA1
SCHEMBL9031247 0.67 ALDH1A1 (0.53) EHMT2MEN1KMT2APOLBPOLA1

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-5095118-A PROCESS FOR THE PREPARATION OF D-(+)-BIOTIN MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-03-10 US disclosed
US-4937351-A Process for the preparation of D-(+)-biotin MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-06-26 US disclosed
US-4877882-A Process for the preparation of D-(+)-biotin MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-10-31 US disclosed