SCHEMBL6789126

SCHEMBL6789126

CC(Cl)(C#N)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.44
TSHR P16473 1/20 0.43
NR1H2 P55055 1/20 0.39
BAX Q07812 1/20 0.39
MAOA P21397 1/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 1/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ERBB2 P04626 1/20 0.36

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
SCHEMBL4744155 0.82 TSHR (0.46) TSHRRAB9AMAPTALDH1A1MAPK1
SCHEMBL27909852 0.79 LTA4H (0.44) LTA4HTSHRNR1H2BAXMAOA
Water SCHEMBL11351130 0.77 TSHR (0.56) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL20558768 0.75 LTA4H (0.52) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL22158987 0.75 LTA4H (0.52) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL7542333 0.74 TSHR (0.59) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL10038560 0.74 LTA4H (0.57) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL19392583 0.74 RAB9A (0.65) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL799841 0.74 RAB9A (0.65) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL2463038 0.74 LTA4H (0.57) LTA4HTSHRNR1H2BAXMAOA

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-6713629-B2 PLANT FUNGICIDE NIPPON SODA CO., LTD. (JP) 2004-03-30 US disclosed
US-20030114649-A1 5,5-Disubstituted thiazolidine derivative pesticides NIPPON SODA CO., LTD. 2003-06-19 US disclosed
US-6476055-B1 5,5-disubstituted thiazolidine derivative pesticides NIPPON SODA CO. LTD. (JP) 2002-11-05 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-20030114649-A1 5,5-Disubstituted thiazolidine derivative pesticides NAT1, DDT, TH LTA4H 1023/4885TSHR 28/4885NR1H2 486/4885

“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.