SCHEMBL12713105

SCHEMBL12713105

CC(C)(C)OC(=O)N1CCC(c2ccc(Cl)cc2OCCCN2CCCCC2)CC1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ TP53 P04637 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ NSD2 O96028 1/20 0.46
▸ EHMT2 Q96KQ7 1/20 0.46
▸ UTS2R Q9UKP6 3/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ CNR1 P21554 1/20 0.43

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
SCHEMBL12713087 0.99 SMN1; SMN2 (0.48) SMN1; SMN2KDM4ENPC1RAB9ATP53
SCHEMBL12713072 0.94 UTS2R (0.46) SMN1; SMN2TP53LMNAUTS2RCNR1
SCHEMBL12713141 0.85 SMN1; SMN2 (0.47) SMN1; SMN2TP53LMNAUTS2RMAPT
SCHEMBL12713154 0.84 SMN1; SMN2 (0.46) SMN1; SMN2TP53LMNAUTS2RMAPT
SCHEMBL12713082 0.83 ALDH1A1 (0.47) SMN1; SMN2KDM4ETP53LMNAALDH1A1
SCHEMBL14431353 0.82 HRH2 (0.52) SMN1; SMN2KDM4ENPC1RAB9ALMNA
SCHEMBL12713162 0.82 CNR1 (0.44) SMN1; SMN2TP53UTS2RCNR1
SCHEMBL12713241 0.81 CHRNB2 (0.45) SMN1; SMN2TP53UTS2RCNR1
SCHEMBL12713160 0.81 ADAM17 (0.44) SMN1; SMN2TP53MAPTCNR1
SCHEMBL14431445 0.81 MC4R (0.51) SMN1; SMN2KDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110086836-A1 Substituted Phenylpiperidine Derivatives As Melanocortin-4 Receptor Modulators SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2011-04-14 — — US disclosed
US-20110086836-A1 Substituted Phenylpiperidine Derivatives As Melanocortin-4 Receptor Modulators SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2011-04-14 — — US disclosed
WO-2007115798-A1 SUBSTITUTED PHENYLPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-10-18 — — WO disclosed
EP-1842846-A1 Phenylpiperidine derivatives as melanocortin-4 receptor modulators Santhera Pharmaceuticals (Schweiz) AG (CH) 2007-10-10 — — EP disclosed
WO-2007096186-A1 SUBSTITUTED PHENYLPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2007-08-30 — — WO disclosed
EP-1826201-A1 Substituted phenylpiperidine derivatives as melanocortin-4 receptor modulators Santhera Pharmaceuticals (Schweiz) AG (CH) 2007-08-29 — — 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 (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-20110086836-A1 Substituted Phenylpiperidine Derivatives As Melanocortin-4 Receptor Modulators MC4R, MC5R, MC3R SMN1; SMN2 1344/4885KDM4E 143/4885NPC1 4702/4885

“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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