SCHEMBL7767010

SCHEMBL7767010

C=COC(=S)c1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.39
HTT P42858 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 3/20 0.39
HPGD P15428 3/20 0.39
PKM P14618 2/20 0.39
ATM Q13315 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NLRP1 Q9C000 1/20 0.39
NTSR1 P30989 1/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
GAA P10253 1/20 0.34
MAPT P10636 3/20 0.34
THRB P10828 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
Benzene SCHEMBL28153022 0.78 AKT1 (0.41) ALDH1A1SMN1; SMN2LMNAHPGDTDP1
SCHEMBL4787335 0.78 AKT1 (0.41) ALDH1A1SMN1; SMN2LMNAHPGDTDP1
SCHEMBL7772521 0.77 NFE2L2 (0.37) ALDH1A1HTTSMN1; SMN2LMNAHPGD
SCHEMBL714705 0.75 TDP1 (0.57) ALDH1A1HTTNPSR1SMN1; SMN2LMNA
SCHEMBL24079384 0.75 ALDH1A1 (0.39) ALDH1A1HTTNPSR1SMN1; SMN2LMNA
SCHEMBL27922085 0.74 KMT2A (0.42) ALDH1A1SMN1; SMN2LMNAHPGDTDP1
SCHEMBL9436697 0.73 TDP1 (0.54) ALDH1A1SMN1; SMN2LMNAHPGDTDP1
SCHEMBL1478850 0.71 ALDH1A1 (0.42) ALDH1A1HTTNPSR1SMN1; SMN2LMNA
Acetic Acid SCHEMBL27691717 0.71 TDP1 (0.52) ALDH1A1HTTNPSR1SMN1; SMN2LMNA
P-Xylene SCHEMBL7063030 0.70 LMNA (0.50) ALDH1A1HTTNPSR1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711813-B1 Antifouling coating composition HITACHI CHEMICAL CO LTD (JP) 2001-07-25 EP disclosed
US-5773508-A BIODEGRADABLE POLYMER OF ADDITION COPOLYMERS FOR PROTECTIVE COATINGS HITACHI CHEMICAL COMPANY, LTD. (JP) 1998-06-30 US disclosed