SCHEMBL7512945

SCHEMBL7512945

CCCCNC(=S)NN1CC(C)CC(C)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
SMN1; SMN2 Q16637 5/20 0.39
ALDH1A1 P00352 3/20 0.38
LMNA P02545 3/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
HTT P42858 3/20 0.35
ALOX12 P18054 2/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
RECQL P46063 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 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
SCHEMBL7512448 0.82 KMT2A (0.48) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL7507205 0.75 LMNA (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL7509993 0.75 ALDH1A1 (0.55) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL17219 0.70 KMT2A (0.57) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL7515932 0.68 KMT2A (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL7532146 0.68 GNAI3 (0.55) KMT2AMEN1CNR1CNR2
SCHEMBL8587014 0.67 GNAI3 (0.49) ALDH1A1
SCHEMBL14860830 0.66 KMT2A (0.53) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL29235627 0.65 LMNA (0.50) KMT2AMEN1SMN1; SMN2ALDH1A1LMNA
SCHEMBL11596181 0.64 EPHX1 (0.60) KMT2AMEN1SMN1; SMN2LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876300-B1 USE OF THIOUREA COMPOUNDS FOR CONTROLLING BIOFOULING BUCKMAN LABOR INC (US) 2002-01-02 EP claimed
US-6075022-A Methods and compositions for controlling biofouling using thiourea compounds BUCKMAN LABORATORIES INTERNATIONAL INC. (US) 2000-06-13 US claimed
EP-0876300-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING THIOUREA COMPOUNDS BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-11-11 EP claimed
WO-1997011911-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING THIOUREA COMPOUNDS BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-04-03 WO claimed
EP-0876300-B1 USE OF THIOUREA COMPOUNDS FOR CONTROLLING BIOFOULING BUCKMAN LABOR INC (US) 2002-01-02 EP disclosed
US-6075022-A Methods and compositions for controlling biofouling using thiourea compounds BUCKMAN LABORATORIES INTERNATIONAL INC. (US) 2000-06-13 US disclosed
EP-0876300-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING THIOUREA COMPOUNDS BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1998-11-11 EP disclosed
WO-1997011911-A1 METHODS AND COMPOSITIONS FOR CONTROLLING BIOFOULING USING THIOUREA COMPOUNDS BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) 1997-04-03 WO disclosed