SCHEMBL13700993

SCHEMBL13700993

CCSc1cc(C)ccc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.52
ALDH1A1 P00352 4/20 0.47
CYP3A4 P08684 2/20 0.47
L3MBTL1 Q9Y468 6/20 0.41
MAPT P10636 5/20 0.41
HPGD P15428 4/20 0.41
POLB P06746 3/20 0.41
KMT2A Q03164 2/20 0.41
MAPK1 P28482 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ALOX12 P18054 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 4/20 0.39
L3MBTL4 Q8NA19 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL16885084 0.81 LMNA (0.45) ALDH1A1L3MBTL1MAPTHPGDPOLB
SCHEMBL13294876 0.79 ACHE (0.60) ACHEALDH1A1CYP3A4L3MBTL1MAPT
SCHEMBL18680907 0.79 KDM4E (0.44) ALDH1A1L3MBTL1KMT2AMEN1USP2
SCHEMBL11095959 0.78 KDM4E (0.50) ACHEALDH1A1L3MBTL1HPGDKMT2A
SCHEMBL31682767 0.77 NPC1 (0.49) ALDH1A1MAPTHPGDKMT2AMAPK1
SCHEMBL11665334 0.76 ACHE (0.43) ACHEALDH1A1CYP3A4L3MBTL1MAPT
SCHEMBL23386690 0.75 L3MBTL1 (0.45) ALDH1A1L3MBTL1MAPTHPGDPOLB
SCHEMBL5882272 0.75 ALDH1A1 (0.58) ALDH1A1L3MBTL1MAPTHPGDPOLB
SCHEMBL23585557 0.75 ALDH1A1 (0.42) ACHEALDH1A1CYP3A4L3MBTL1MAPT
SCHEMBL8444448 0.74 MTNR1A (0.51) ALDH1A1L3MBTL1HPGDKMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595415-B2 α-Substituted vinyltin compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-09-29 US disclosed
US-7595415-B2 α-Substituted vinyltin compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-09-29 US disclosed
US-20090023939-A1 ALPHA-SUBSTITUTED VINYLTIN COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-01-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090023939-A1 ALPHA-SUBSTITUTED VINYLTIN COMPOUND TST, CCNT1, TMT1A ACHE 1935/4885ALDH1A1 1313/4885CYP3A4 1326/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.