SCHEMBL6752302

SCHEMBL6752302

Cc1cccc(/C=C/C(=O)CC(C)c2cccc3ccccc23)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
BACE1 P56817 2/20 0.41
EGFR P00533 1/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MAPT P10636 2/20 0.38
LMNA P02545 3/20 0.38
NPC1 O15118 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 1/20 0.38
XBP1 P17861 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
HPGD P15428 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
SCHEMBL13855361 0.84 MEN1 (0.51) MAOAMAOBMAPTLMNAKDM4E
SCHEMBL6752550 0.79 TDP1 (0.50) MAOAMAOBEGFRMMP1MMP2
SCHEMBL6752558 0.78 CYP2C9 (0.43) LMNAALDH1A1GAAHPGD
SCHEMBL6752276 0.78 CYP2C9 (0.43) LMNAALDH1A1GAAHPGD
SCHEMBL14205237 0.73 MAOA (0.56) MAOAMAOBBACE1EGFRMMP1
SCHEMBL2440214 0.72 IAPP (0.62) MAOAMAOBEGFRMMP1MMP2
SCHEMBL13287417 0.72 IAPP (0.62) MAOAMAOBEGFRMMP1MMP2
SCHEMBL2441249 0.72 IAPP (0.62) MAOAMAOBEGFRMMP1MMP2
SCHEMBL27832635 0.72 IAPP (0.62) MAOAMAOBEGFRMMP1MMP2
SCHEMBL3360114 0.72 IAPP (0.58) MAOAMAOBBACE1EGFRMMP1

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-8183415-B2 Methods of synthesizing cinacalcet and salts thereof AMGEN, INC. (US) 2012-05-22 US disclosed
US-20110281954-A1 METHODS OF SYNTHESIZING CINACALCET AND SALTS THEREOF AMGEN INC. 2011-11-17 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-20110281954-A1 METHODS OF SYNTHESIZING CINACALCET AND SALTS THEREOF ACE, SI, REN MAOA 4639/4885MAOB 4657/4885BACE1 496/4885

“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.