SCHEMBL2807534

SCHEMBL2807534

O=C(O)NC1(Cc2ccc3c(Cl)c[nH]c3c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRKAB2 O43741 9/20 0.38
▸ PRKAG1 P54619 9/20 0.38
▸ PRKAA2 P54646 9/20 0.38
▸ PRKAA1 Q13131 9/20 0.38
▸ PRKAG3 Q9UGI9 9/20 0.38
▸ PRKAG2 Q9UGJ0 9/20 0.38
▸ PRKAB1 Q9Y478 9/20 0.38
▸ F10 P00742 8/20 0.37
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ MDH2 P40926 1/20 0.35
▸ PTGER4 P35408 1/20 0.34
▸ PDE3A Q14432 1/20 0.34

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
SCHEMBL27591616 0.74 HPGD (0.51) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL2807531 0.70 MC4R (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL30166609 0.70 PRKAB2 (0.49) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL2806939 0.70 PRKAB2 (0.49) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL2808561 0.70 SLC22A12 (0.42) PTGER4
SCHEMBL31369839 0.69 SLC7A5 (0.50) —
SCHEMBL16040906 0.68 ADRB2 (0.44) —
SCHEMBL18508853 0.67 KIF11 (0.47) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL27774896 0.66 GPR84 (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL5913507 0.66 MAOA (0.42) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8975252-B2 Morpholine derivative SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2015-03-10 — — US disclosed
US-20100240644-A1 MORPHOLINE DERIVATIVE SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2010-09-23 — — 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-20100240644-A1 MORPHOLINE DERIVATIVE REN, AGTR1, AGTR2 PRKAB2 4083/4885PRKAG1 4397/4885PRKAA2 1995/4885

“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.

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