SCHEMBL13131395

SCHEMBL13131395

CCc1cc(Cl)c2c(C)nn(CCCOC)c2c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 14/20 0.45
▸ NR3C1 P04150 2/20 0.39
▸ GLA P06280 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ADORA2A P29274 1/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ HTR1A P08908 2/20 0.33
▸ DRD2 P14416 2/20 0.33
▸ DRD4 P21917 2/20 0.33
▸ HTR2A P28223 2/20 0.33
▸ HTR2C P28335 2/20 0.33
▸ DRD3 P35462 2/20 0.33

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
SCHEMBL13131392 0.87 REN (0.35) RENNR3C1GLAKMT2ATDP1
SCHEMBL13131393 0.86 REN (0.42) RENNR3C1GLAADORA2AADORA2B
SCHEMBL13132412 0.82 REN (0.46) RENNR3C1KMT2A
SCHEMBL12525523 0.79 REN (0.48) RENNR3C1KMT2A
SCHEMBL13168643 0.78 MAP4K4 (0.32) KMT2AADORA2AADORA2B
SCHEMBL2806185 0.78 REN (0.56) REN
SCHEMBL2806190 0.78 REN (0.45) RENNR3C1
SCHEMBL13132275 0.78 REN (0.36) RENNR3C1GLAKMT2ATDP1
SCHEMBL13131423 0.76 ADORA2A (0.44) RENADORA2AADORA2B
SCHEMBL13131389 0.75 PDE4D (0.39) RENKMT2AHTR1ADRD2DRD4

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 1/4885NR3C1 1114/4885GLA 3092/4885

“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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