SCHEMBL11200673

SCHEMBL11200673

O=C(CCl)NC(=S)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
ALDH1A1 P00352 5/20 0.46
LMNA P02545 1/20 0.46
EPHX2 P34913 1/20 0.46
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
AKR1B1 P15121 1/20 0.45
HPGD P15428 3/20 0.45
GAA P10253 2/20 0.45
HTT P42858 1/20 0.45
NCOA1 Q15788 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
ATM Q13315 1/20 0.44
POLB P06746 1/20 0.43
CNR1 P21554 1/20 0.42
TRPV1 Q8NER1 1/20 0.42

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
SCHEMBL16587378 0.87 MEN1 (0.59) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL6765925 0.76 ALDH1A1 (0.65) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL10202166 0.75 ALDH1A1 (0.58) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL4822650 0.72 MEN1 (0.65) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL699925 0.72 MEN1 (0.71) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL9532375 0.72 ALDH1A1 (0.50) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL3565748 0.70 ALDH1A1 (0.57) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL14817549 0.70 ALDH1A1 (0.61) KMT2AMEN1HDAC8HDAC6ALDH1A1
Phenylthioacetylglycine SCHEMBL11381408 0.70 AKR1B1 (0.54) KMT2AMEN1HDAC8HDAC6ALDH1A1
SCHEMBL19371412 0.70 RAB9A (0.70) KMT2AMEN1ALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4394520-A SKIN DISORDERS SOCIETE ANONYME DITE: L'OREAL (FR) 1983-07-19 US disclosed
US-4204064-A FOR TREATMENT OF SKIN OR SCALP L'OREAL (FR) 1980-05-20 US disclosed
US-4085217-A DERIVATIVES OF CYSTEINE OR CYSTEAMINE L'OREAL (FR) 1978-04-18 US disclosed
US-3976781-A SULFUR CONTAINING AMINES L'OREAL (FR) 1976-08-24 US disclosed