SCHEMBL11655475

SCHEMBL11655475

C=CCOC(=O)NC(=S)Nc1ccccc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
HSD17B10 Q99714 3/20 0.49
TSHR P16473 1/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
ALOX15 P16050 1/20 0.49
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
HDAC3 O15379 6/20 0.41
HDAC1 Q13547 6/20 0.41
HDAC2 Q92769 6/20 0.41
NCOR2 Q9Y618 3/20 0.41
HDAC10 Q969S8 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
HDAC4 P56524 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41

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
SCHEMBL11694355 0.90 ALDH1A1 (0.59) ALDH1A1HSD17B10TSHRLMNAHPGD
SCHEMBL11884603 0.83 HSD17B10 (0.51) ALDH1A1HSD17B10LMNAHPGDALOX15
SCHEMBL11525503 0.82 ALDH1A1 (0.56) ALDH1A1HSD17B10LMNAHPGDALOX15
SCHEMBL11694686 0.81 EPHX1 (0.51) ALDH1A1HSD17B10LMNAKMT2AMEN1
SCHEMBL10905206 0.79 ALDH1A1 (0.78) ALDH1A1HSD17B10LMNAHPGDALOX15
SCHEMBL11741162 0.77 ALDH1A1 (0.50) ALDH1A1HSD17B10TSHRLMNAHPGD
SCHEMBL11876888 0.77 ALDH1A1 (0.56) ALDH1A1HSD17B10LMNAHPGDALOX15
SCHEMBL11679013 0.76 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRLMNAHPGD
SCHEMBL11679654 0.76 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRLMNAHPGD
SCHEMBL11795388 0.76 ALDH1A1 (0.43) ALDH1A1HSD17B10LMNAHPGDALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4075348-A ALKYL ALLOPHANATES, METHOD FOR PREPARATION AND FUNGICIDAL USE OF THE SAME AMERICAN CYANAMID COMPANY (US) 1978-02-21 US disclosed
US-4045470-A Alkyl allophanates, method for preparation and fungicidal use of the same AMERICAN CYANAMID COMPANY (US) 1977-08-30 US disclosed
US-4018926-A Alkyl 4-[o-(substituted methyleneamino)-phenyl]-3-thioallophanate miticides and fungicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-04-19 US disclosed
US-4018926-A Alkyl 4-[o-(substituted methyleneamino)-phenyl]-3-thioallophanate miticides and fungicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-04-19 US disclosed
US-4011213-A FUNGICIDES, MITE OVICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-03-08 US disclosed
US-4011213-A FUNGICIDES, MITE OVICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-03-08 US disclosed
US-4010278-A FUNGICIDES, MITE OVICIDES E. I. DU PONT DE NEMOURS AND CO. (US) 1977-03-01 US disclosed
US-3958007-A FUNGICIDES, MITE OVICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-05-18 US disclosed
US-3958007-A FUNGICIDES, MITE OVICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-05-18 US disclosed
US-3950391-A FUNGICIDES, MITICIDES, OVICIDES ADAMS CHARLES D 1976-04-13 US disclosed
US-3950391-A FUNGICIDES, MITICIDES, OVICIDES ADAMS CHARLES D 1976-04-13 US disclosed
US-3950391-A FUNGICIDES, MITICIDES, OVICIDES ADAMS CHARLES D 1976-04-13 US disclosed
US-3943163-A FUNGICIDE, MITE OVICIDE E. I. DU PONT DE NEMOURS & CO. (US) 1976-03-09 US disclosed