Dimpylate

Dimpylate

SCHEMBL1344740

CCOP(=S)(OCC)Oc1cc(C)nc(C(C)C)n1.[H+]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.97
TSHR P16473 4/20 0.97
CYP3A4 P08684 4/20 0.97
HSD17B10 Q99714 3/20 0.97
TP53 P04637 1/20 0.97
ACHE P22303 1/20 0.97
TDP1 Q9NUW8 5/20 0.59
MAPT P10636 4/20 0.41
MAPK1 P28482 2/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 3/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA3 P07451 1/20 0.30

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
Dimpylate SCHEMBL6118696 0.99 ALDH1A1 (1.00) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL17453 0.99 ALDH1A1 (1.00) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL28091934 0.97 ALDH1A1 (0.97) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL27949432 0.97 ALDH1A1 (0.97) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL6214077 0.97 ALDH1A1 (0.97) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL6753267 0.97 ALDH1A1 (0.97) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL3841005 0.97 ALDH1A1 (0.97) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL4880297 0.96 ALDH1A1 (0.94) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL6891644 0.96 ALDH1A1 (0.94) ALDH1A1TSHRCYP3A4HSD17B10TP53
Dimpylate SCHEMBL20770701 0.94 ALDH1A1 (0.92) ALDH1A1TSHRCYP3A4HSD17B10TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113429998-B Gasoline adsorption desulfurization intelligent control system and equipment 北京赛普泰克技术有限公司 2023-02-17 CN disclosed
CN-113429998-A Gasoline adsorption desulfurization intelligent control system and equipment 北京赛普泰克技术有限公司 2021-09-24 CN disclosed
US-8065243-B2 Optimizing operations of a hydrogen pipeline system AIR LIQUIDE LARGE INDUSTRIES U.S. LP (US) 2011-11-22 US disclosed
CN-102084394-A Optimizing operations of a hydrogen pipeline system AIR LIQUIDE 2011-06-01 CN disclosed
WO-2009137253-A2 OPTIMIZING OPERATIONS OF A HYDROGEN PIPELINE SYSTEM L'AIR LIQUIDE SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2009-11-12 WO disclosed
US-20090265292-A1 OPTIMIZING OPERATIONS OF A HYDROGEN PIPELINE SYSTEM AIR LIQUIDE LARGE INDUSTRIES U.S. LP 2009-10-22 US disclosed