SCHEMBL2813360

SCHEMBL2813360

COCCCn1cc(CC2(NC(=O)O)CC2)c2c(Cc3ccccc3)cccc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 3/20 0.42
▸ CNR1 P21554 2/20 0.42
▸ REN P00797 3/20 0.40
▸ HDAC3 O15379 1/20 0.39
▸ P2RX7 Q99572 9/20 0.38
▸ IL1B P01584 5/20 0.38
▸ HTR6 P50406 2/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MCL1 Q07820 1/20 0.35

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
SCHEMBL2812259 0.86 REN (0.43) CNR2CNR1RENP2RX7IL1B
SCHEMBL13131364 0.83 HTR6 (0.41) CNR2CNR1RENHDAC3P2RX7
SCHEMBL2813356 0.79 REN (0.57) RENKCNH2
SCHEMBL13132368 0.76 MEN1 (0.42) CNR2CNR1RENHDAC3P2RX7
SCHEMBL13132273 0.73 REN (0.52) RENKCNH2
SCHEMBL2810161 0.73 REN (0.35) CNR2CNR1RENHDAC3KCNH2
SCHEMBL13131362 0.70 REN (0.51) CNR2CNR1RENP2RX7IL1B
SCHEMBL2805278 0.70 CDC25A (0.45) CNR2CNR1HDAC3HTR6MCL1
SCHEMBL2833989 0.69 HRH1 (0.37) RENKCNH2ALDH1A1
SCHEMBL13131575 0.68 REN (0.82) RENKCNH2

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 CNR2 612/4885CNR1 520/4885REN 1/4885

“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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