SCHEMBL16075083

SCHEMBL16075083

CNC(=O)[C@@H](C)c1ccccc1COc1cc(C)ccc1C

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 2/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
CYP2C9 P11712 1/20 0.40
USP2 O75604 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL16075027 1.00 LPAR1 (0.45) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL12315742 1.00 LPAR1 (0.45) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL3498225 0.88 SMN1; SMN2 (0.44) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL3498222 0.88 SMN1; SMN2 (0.44) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL12317527 0.87 CD274 (0.41) ALDH1A1PTGDR2MEN1KMT2ABCHE
SCHEMBL1688212 0.86 SMN1; SMN2 (0.43) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL182597 0.86 SMN1; SMN2 (0.45) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL29365871 0.86 SMN1; SMN2 (0.45) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL16858325 0.86 SMN1; SMN2 (0.45) LPAR1SMN1; SMN2LMNAHTTALDH1A1
SCHEMBL7972530 0.86 SMN1; SMN2 (0.43) LPAR1SMN1; SMN2LMNAHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9089130-B2 Composition and method for controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-07-28 US disclosed
US-20140296269-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-10-02 US disclosed
US-20140288104-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-25 US disclosed
US-20140275052-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-18 US disclosed
US-20140275053-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-18 US disclosed
US-20140275051-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-18 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 (5 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-20140275052-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES FLNB, MTX2, PNPO LPAR1 4154/4885SMN1; SMN2 3733/4885LMNA 2981/4885
US-20140288104-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES MDN1, PNPO, FLNB LPAR1 4346/4885SMN1; SMN2 3661/4885LMNA 2735/4885
US-20140275053-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES MDN1, PNPO, MTX2 LPAR1 4308/4885SMN1; SMN2 3647/4885LMNA 2721/4885
US-20140275051-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES MDN1, PNPO, FLNB LPAR1 4346/4885SMN1; SMN2 3661/4885LMNA 2735/4885
US-20140296269-A1 COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES MDN1, PNPO, MTX2 LPAR1 4308/4885SMN1; SMN2 3647/4885LMNA 2721/4885

“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.