SCHEMBL2806953

SCHEMBL2806953

COCCCn1nc(C2=CCCC2)c2ccc(CC3(NC(=O)O)CC3)cc21

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 5/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ GUCY1A1 Q02108 2/20 0.32
▸ GUCY1B1 Q02153 2/20 0.32
▸ PTGER1 P34995 2/20 0.32
▸ HTR4 Q13639 2/20 0.32
▸ KCNH2 Q12809 1/20 0.32

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
SCHEMBL2808531 0.83 REN (0.37) RENMEN1KMT2AHTR4KCNH2
SCHEMBL2806950 0.81 REN (0.42) REN
SCHEMBL2813583 0.80 SLC22A12 (0.39) RENHTR4KCNH2
SCHEMBL2833989 0.79 HRH1 (0.37) RENMEN1KMT2AHTR4KCNH2
SCHEMBL2810347 0.79 KDM4C (0.40) RENMEN1KMT2AHTR4KCNH2
SCHEMBL13132444 0.76 ITK (0.39) RENMEN1KMT2A
SCHEMBL2840438 0.72 REN (0.37) RENHTR4KCNH2
SCHEMBL2806190 0.72 REN (0.45) RENHTR4KCNH2
SCHEMBL13131760 0.69 REN (0.61) REN
SCHEMBL2805458 0.66 HTR4 (0.37) RENHTR4KCNH2

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 REN 1/4885MEN1 167/4885KMT2A 1278/4885

“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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