SCHEMBL28069388

SCHEMBL28069388

CCO[C@@H](CC)NC(N)=S

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
THRB P10828 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
TAS2R38 P59533 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
SCHEMBL28130733 1.00 ALDH1A1 (0.32) ALDH1A1HPGDTHRBCA12CA1
SCHEMBL5437578 0.80
SCHEMBL11443514 0.73 ALDH1A1 (0.35) ALDH1A1THRBCA12CA1CA2
SCHEMBL28370418 0.72
SCHEMBL6580192 0.69 TSHR (0.47) ALDH1A1
SCHEMBL11380859 0.69 ALDH1A1 (0.33) ALDH1A1HPGD
SCHEMBL19695734 0.69
Methylamine SCHEMBL770382 0.69 THRB (0.38) THRB
SCHEMBL10905874 0.69
SCHEMBL9494964 0.68 GAA (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105772085-B (S) the thiourea modified Cr Anderson types heteropolyacid catalyst of 1 (1 ethoxy, 1 isopropyl), preparation method and applications 上海应用技术学院 2018-04-13 CN claimed
CN-106513040-A (S)-1-(1-hydroxyethyl-1-isopropyl)thiourea-modified Al-Anderson type heteropoly acid catalyst, preparation method and application thereof 上海应用技术大学 2017-03-22 CN claimed
CN-106475140-A (S) the unilateral Fe Anderson type heteropolyacid catalyst modified of 1 (1 ethoxy 1 isopropyl) thiourea, preparation method and applications 上海应用技术大学 2017-03-08 CN claimed
CN-105772086-A (S)-1-(1-hydroxyethyl-1-isopropyl) thiourea modified Mn-Anderson type heteropoly acid catalyst, and preparation method and application thereof 上海应用技术学院 2016-07-20 CN claimed
CN-105772085-A Cr-Anderson type heteropolyacid catalyst modified by (S)-1-(1-ethoxyl-1-isopropyl) thiourea, and preparation method and application thereof 上海应用技术学院 2016-07-20 CN claimed
CN-105772085-B (S) the thiourea modified Cr Anderson types heteropolyacid catalyst of 1 (1 ethoxy, 1 isopropyl), preparation method and applications 上海应用技术学院 2018-04-13 CN disclosed
CN-105772086-B (S) the thiourea modified Mn Anderson types heteropolyacid catalyst of 1 (isopropyl of 1 ethoxy 1), preparation method and applications 上海应用技术学院 2018-03-30 CN disclosed
CN-106513040-A (S)-1-(1-hydroxyethyl-1-isopropyl)thiourea-modified Al-Anderson type heteropoly acid catalyst, preparation method and application thereof 上海应用技术大学 2017-03-22 CN disclosed
CN-106475140-A (S) the unilateral Fe Anderson type heteropolyacid catalyst modified of 1 (1 ethoxy 1 isopropyl) thiourea, preparation method and applications 上海应用技术大学 2017-03-08 CN disclosed
CN-105772085-A Cr-Anderson type heteropolyacid catalyst modified by (S)-1-(1-ethoxyl-1-isopropyl) thiourea, and preparation method and application thereof 上海应用技术学院 2016-07-20 CN disclosed
CN-105772085-A Cr-Anderson type heteropolyacid catalyst modified by (S)-1-(1-ethoxyl-1-isopropyl) thiourea, and preparation method and application thereof 上海应用技术学院 2016-07-20 CN disclosed
CN-105772085-A Cr-Anderson type heteropolyacid catalyst modified by (S)-1-(1-ethoxyl-1-isopropyl) thiourea, and preparation method and application thereof 上海应用技术学院 2016-07-20 CN disclosed