SCHEMBL9736877

SCHEMBL9736877

CC(=O)SC[C@H]1[C@@H](C(=O)O)N(Cc2ccccc2)C(=O)N1Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.41
BRD4 O60885 1/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 2/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
F2 P00734 1/20 0.36
PLG P00747 1/20 0.36
ELANE P08246 1/20 0.36
CTSG P08311 1/20 0.36
CMA1 P23946 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
SCHEMBL9736566 1.00 EHMT2 (0.41) EHMT2BRD4KMT2AMEN1KDM4E
SCHEMBL9737467 0.81 EHMT2 (0.35) EHMT2KMT2AMEN1KDM4EALDH1A1
SCHEMBL11174084 0.80 EHMT2 (0.47) EHMT2KMT2AMEN1KDM4EALDH1A1
SCHEMBL11174081 0.80 EHMT2 (0.47) EHMT2KMT2AMEN1KDM4EALDH1A1
SCHEMBL11174075 0.80 EHMT2 (0.47) EHMT2KMT2AMEN1KDM4EALDH1A1
SCHEMBL351271 0.80 EHMT2 (0.56) EHMT2BRD4KMT2AMEN1POLB
SCHEMBL22130803 0.80 EHMT2 (0.56) EHMT2BRD4KMT2AMEN1POLB
SCHEMBL353717 0.80 EHMT2 (0.56) EHMT2BRD4KMT2AMEN1POLB
SCHEMBL9679741 0.79 EHMT2 (0.46) EHMT2BRD4KMT2AMEN1POLB
SCHEMBL3084318 0.79 EHMT2 (0.46) EHMT2BRD4KMT2AMEN1POLB

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
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
US-4837402-A Process for the preparation of D-(+)-biotin MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-06-06 US disclosed
US-4732987-A Process for the preparation of D-(+)-biotin MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-03-22 US disclosed