SCHEMBL10026850

SCHEMBL10026850

COCCNC(=O)c1cccc(CC(C)(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 1/20 0.54
▸ HPGD P15428 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ ROCK2 O75116 1/20 0.51
▸ ALDH1A1 P00352 2/20 0.50
▸ KDM1A O60341 1/20 0.49
▸ LOX P28300 2/20 0.48
▸ LOXL2 Q9Y4K0 2/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ ACACB O00763 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ POLB P06746 1/20 0.47

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
SCHEMBL14233714 0.87 L3MBTL1 (0.63) SMN1; SMN2NPC1RAB9AROCK2ALDH1A1
SCHEMBL18718023 0.84 SMN1; SMN2 (0.72) MRGPRX4SMN1; SMN2NPC1RAB9AROCK2
SCHEMBL2056391 0.84 HPGD (0.57) MRGPRX4HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL23471233 0.84 MRGPRX4 (0.60) MRGPRX4HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL8284791 0.84 HPGD (0.57) MRGPRX4HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL21015600 0.84 MRGPRX4 (0.54) MRGPRX4HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL1690502 0.83 RAB9A (0.68) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL19634293 0.83 LOXL2 (0.65) MRGPRX4HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL21015342 0.83 ROCK2 (0.54) MRGPRX4HPGDSMN1; SMN2NPC1RAB9A
SCHEMBL17032313 0.82 CNR2 (0.48) SMN1; SMN2NPC1RAB9AROCK2ALDH1A1

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-20120022040-A1 ANTIMICROBIALS AMPLYX PHARMACEUTICALS, INC. 2012-01-26 — — 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-20120022040-A1 ANTIMICROBIALS PAM, MPO, OXA1L MRGPRX4 3081/4885HPGD 536/4885SMN1; SMN2 1426/4885

“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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