SCHEMBL13041624

SCHEMBL13041624

CC(C)N1C(=O)N(C2CC2)Cc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 11/20 0.47
▸ RAMP1 O60894 1/20 0.43
▸ CALCRL Q16602 1/20 0.43
▸ OPRM1 P35372 4/20 0.40
▸ OPRK1 P41145 4/20 0.40
▸ OPRL1 P41146 4/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ PARP1 P09874 2/20 0.38
▸ PARP2 Q9UGN5 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL13041636 0.94 C5AR1 (0.45) C5AR1RAMP1CALCRLOPRM1OPRK1
SCHEMBL26661186 0.78 SMN1; SMN2 (0.39) ALDH1A1HTT
SCHEMBL13015326 0.78 BRD4 (0.42) OPRM1OPRK1OPRL1PARP1ALDH1A1
SCHEMBL13041646 0.77 MAPK1 (0.47) C5AR1ALDH1A1
SCHEMBL13041632 0.77 IDH1 (0.37) C5AR1RAMP1CALCRLPARP1PARP2
SCHEMBL13041641 0.75 BRD4 (0.41) OPRM1OPRK1OPRL1PARP1ALDH1A1
SCHEMBL13041645 0.74 C5AR1 (0.46) C5AR1
SCHEMBL13041629 0.74 SMN1; SMN2 (0.36) C5AR1RAMP1CALCRLALDH1A1
SCHEMBL13041639 0.73 PARP1 (0.43) RAMP1CALCRLOPRM1OPRK1OPRL1
SCHEMBL13041644 0.72 OPRL1 (0.42) OPRM1OPRK1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100278835-A1 NOVEL COMPOUNDS 660 ASTRAZENECA UK LIMITED (GB) 2010-11-04 — — 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-20100278835-A1 NOVEL COMPOUNDS 660 RB1, RPP30, SARS1 C5AR1 265/4885RAMP1 3380/4885CALCRL 3162/4885

“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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