SCHEMBL5618352

SCHEMBL5618352

Clc1ccc(CN2CCOCC2)cc1Cl

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.71
POLB P06746 1/20 0.71
SIGMAR1 Q99720 3/20 0.70
HRH3 Q9Y5N1 2/20 0.67
CYP2A13 Q16696 3/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.56
TP53 P04637 1/20 0.56
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.56
RAB9A P51151 1/20 0.56
NCF1 P14598 1/20 0.56
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54

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
SCHEMBL14872333 0.86 HRH3 (0.59) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13
SCHEMBL16076176 0.86 HRH3 (0.59) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13
SCHEMBL27087826 0.86 HRH3 (0.59) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13
SCHEMBL632550 0.86 HRH3 (0.59) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13
SCHEMBL15467001 0.86 HRH3 (0.87) SMN1; SMN2HRH3CYP2A13KMT2AMEN1
SCHEMBL13161945 0.86 HRH3 (0.62) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13
SCHEMBL6795896 0.85 POLB (0.96) SMN1; SMN2POLBSIGMAR1HRH3TP53
SCHEMBL28184444 0.84 HRH3 (0.61) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13
SCHEMBL1141938 0.84 HRH3 (0.61) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13
SCHEMBL1552775 0.84 HRH3 (0.61) SMN1; SMN2POLBSIGMAR1HRH3CYP2A13

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
US-10435394-B2 Plant growth-promotion agent and method for promoting plant growth RIKEN (JP) 2019-10-08 US disclosed
US-10435394-B2 Plant growth-promotion agent and method for promoting plant growth RIKEN (JP) 2019-10-08 US disclosed
EP-2042499-B1 SALT OF A MORPHOLINE COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2018-06-27 EP disclosed
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH RIKEN (JP) 2017-10-26 US disclosed
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH RIKEN (JP) 2017-10-26 US disclosed
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH RIKEN (JP) 2017-10-26 US disclosed
WO-2007071936-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND THEIR USE AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2007-06-28 WO disclosed
US-7157457-B2 Compounds useful in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2007-01-02 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 (2 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-10435394-B2 Plant growth-promotion agent and method for promoting plant growth NPR1, NAT1, NOS1 SMN1; SMN2 4272/4885POLB 2985/4885SIGMAR1 2311/4885
US-20170305886-A1 PLANT GROWTH-PROMOTION AGENT AND METHOD FOR PROMOTING PLANT GROWTH NPR1, NAT1, NOS1 SMN1; SMN2 4272/4885POLB 2985/4885SIGMAR1 2311/4885

“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.