SCHEMBL20335486

SCHEMBL20335486

CCCN1C(=O)CC(C)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
POLB P06746 1/20 0.48
PKM P14618 1/20 0.48
TSHR P16473 1/20 0.48
OPRM1 P35372 1/20 0.45
OPRK1 P41145 1/20 0.45
OPRL1 P41146 1/20 0.45
CYP19A1 P11511 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
NOTUM Q6P988 1/20 0.40
CDC25A P30304 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38

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
SCHEMBL6264071 0.86 OPRM1 (0.44) ALDH1A1POLBPKMTSHROPRM1
SCHEMBL9689641 0.84 OPRK1 (0.42) ALDH1A1POLBPKMTSHROPRM1
SCHEMBL22692403 0.81 ALDH1A1 (0.42) ALDH1A1POLBPKMTSHROPRM1
SCHEMBL20335475 0.80 CYP19A1 (0.50) ALDH1A1POLBPKMTSHRCYP19A1
SCHEMBL31469975 0.78 OPRM1 (0.50) ALDH1A1TSHROPRM1OPRK1OPRL1
SCHEMBL6746146 0.78 OPRM1 (0.50) ALDH1A1TSHROPRM1OPRK1OPRL1
SCHEMBL20335477 0.76 ALDH1A1 (0.47) ALDH1A1POLBKMT2ACYP1A2
SCHEMBL8083936 0.74 LMNA (0.46) ALDH1A1POLBPKMTSHRKMT2A
SCHEMBL28230741 0.73 OPRM1 (0.49) TSHROPRM1OPRK1OPRL1KMT2A
SCHEMBL20548554 0.73 ALDH1A1 (0.49) ALDH1A1POLBPKMTSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3342766-B1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2020-12-09 EP disclosed
EP-3342766-B1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2020-12-09 EP disclosed
US-10842151-B2 Small molecule compound for enhancing plant stress resistance CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2020-11-24 US disclosed
US-10842151-B2 Small molecule compound for enhancing plant stress resistance CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2020-11-24 US disclosed
US-20180360039-A1 Small Molecule Compound for Enhancing Plant Stress Resistance CAS CENTER FOR EXCELLENCE IN MOLECULAR PLANT SCIENCES (CN) 2018-12-20 US disclosed
EP-3342766-A1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE Shanghai Institutes for Biological Sciences, Chinese Academy of Sciences (CN) 2018-07-04 EP disclosed
EP-3342766-A1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE Shanghai Institutes for Biological Sciences, Chinese Academy of Sciences (CN) 2018-07-04 EP 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-10842151-B2 Small molecule compound for enhancing plant stress resistance CYP4F11, RICTOR, MYB ALDH1A1 2410/4885POLB 3150/4885PKM 1265/4885
US-20180360039-A1 Small Molecule Compound for Enhancing Plant Stress Resistance CYP4F11, RICTOR, MYB ALDH1A1 2410/4885POLB 3150/4885PKM 1265/4885

“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.