SCHEMBL9679059

SCHEMBL9679059

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.38
KDM4E B2RXH2 2/20 0.37
LMNA P02545 2/20 0.37
MMP1 P03956 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 3/20 0.35
POLA1 P09884 2/20 0.35
ABL1 P00519 1/20 0.35
RIN1 Q13671 1/20 0.35
ALDH1A1 P00352 3/20 0.35
ALOX15 P16050 1/20 0.35
FPR1 P21462 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
HPGD P15428 2/20 0.34
MAPK10 P53779 1/20 0.34

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 1.00 EHMT2 (0.38) EHMT2KDM4ELMNAMMP1MMP3
SCHEMBL9679618 0.87 EHMT2 (0.42) EHMT2KDM4EMEN1KMT2APOLB
SCHEMBL9737467 0.85 EHMT2 (0.35) EHMT2KDM4ELMNAMEN1KMT2A
SCHEMBL9679741 0.78 EHMT2 (0.46) EHMT2MEN1KMT2APOLBHDAC6
SCHEMBL3084318 0.78 EHMT2 (0.46) EHMT2MEN1KMT2APOLBHDAC6
SCHEMBL3092207 0.76 EHMT2 (0.44) EHMT2MEN1KMT2APOLBFPR1
SCHEMBL9845295 0.74 MEN1 (0.42) EHMT2KDM4ELMNAMEN1KMT2A
SCHEMBL9032586 0.74 MEN1 (0.42) EHMT2KDM4ELMNAMEN1KMT2A
SCHEMBL9845296 0.74 MEN1 (0.39) EHMT2KDM4ELMNAMEN1KMT2A
SCHEMBL6049147 0.70 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 7 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
EP-0242686-B1 PROCESS FOR THE PREPARATION OF D-(+)-BIOTINE MERCK PATENT GmbH (DE) 1992-01-29 EP 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
EP-0242686-A2 Process for the preparation of D-(+)-biotine MERCK PATENT GmbH (DE) 1987-10-28 EP disclosed