SCHEMBL5643123

SCHEMBL5643123

O=C(O)CC(=O)CCc1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.66
FFAR1 O14842 2/20 0.59
PLAAT3 P53816 1/20 0.51
PLAAT5 Q96KN8 1/20 0.51
PLAAT2 Q9NWW9 1/20 0.51
PLAAT4 Q9UL19 1/20 0.51
HTT P42858 1/20 0.50
LMNA P02545 2/20 0.49
GAA P10253 1/20 0.49
F2RL1 P55085 1/20 0.49
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
SLC5A1 P13866 1/20 0.47
SLC5A2 P31639 1/20 0.47
HPGD P15428 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
SCHEMBL27802263 0.89 LMNA (0.56) MMP12FFAR1PLAAT3PLAAT5PLAAT2
SCHEMBL7332325 0.86 FFAR1 (0.58) FFAR1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL10853169 0.85 FFAR1 (0.64) MMP12FFAR1PLAAT3PLAAT5PLAAT2
SCHEMBL193318 0.84 FFAR1 (0.79) FFAR1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL2862583 0.82 MMP12 (0.68) MMP12FFAR1LMNAGAAF2RL1
SCHEMBL1532408 0.82 MMP12 (0.79) MMP12FFAR1PLAAT5PLAAT4HTT
Hydrochloric Acid SCHEMBL29184696 0.82 FFAR1 (0.76) FFAR1PLAAT3PLAAT5PLAAT2PLAAT4
Hydrochloric Acid SCHEMBL28568409 0.82 FFAR1 (0.76) FFAR1PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL7508200 0.81 MMP12 (0.66) MMP12FFAR1PLAAT3PLAAT5PLAAT2
SCHEMBL755111 0.80 F2RL1 (0.57) MMP12FFAR1PLAAT3PLAAT5PLAAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189851-B2 Condensed heterocyclic compounds as calcitonin agonists SMITHKLINE BEECHAM CORPORATION (US) 2007-03-13 US disclosed
US-20050107419-A1 Condensed heterocyclic compounds as calcitonin agonists SMITHKLINE BEECHAM CORPORATION 2005-05-19 US disclosed
WO-2003076440-A1 CONDENSED HETEROCYCLIC COMPOUNDS AS CALCITONIN AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-18 WO 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-20050107419-A1 Condensed heterocyclic compounds as calcitonin agonists CALCRL, CALCR, CALCB MMP12 3732/4885FFAR1 664/4885PLAAT3 1843/4885

“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.