SCHEMBL3582422

SCHEMBL3582422

CSC[C@@H](COc1cccc(F)c1)NC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.43
ADAMTS4 O75173 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
GPR34 Q9UPC5 1/20 0.41
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
NR4A2 P43354 1/20 0.40
USP2 O75604 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL3582664 0.81 MTNR1A (0.57) MRGPRX4MTNR1AMTNR1B
SCHEMBL3573117 0.75 TRPV1 (0.50)
SCHEMBL3585190 0.74 SMN1; SMN2 (0.52) MTNR1AMTNR1BMEN1KMT2A
SCHEMBL11667681 0.74 MAOB (0.49) MRGPRX4NR4A2USP2MEN1ALDH1A1
SCHEMBL3566335 0.73 SMN1; SMN2 (0.51) MEN1ALDH1A1KMT2A
SCHEMBL10880786 0.72 HTR1D (0.47) GPR34MTNR1AMTNR1B
SCHEMBL3577544 0.71 TRPV4 (0.46) MRGPRX4PPARGPPARAGPR34NR4A2
SCHEMBL28437354 0.71 PPARG (0.51) MRGPRX4PPARGPPARAGPR34NR4A2
SCHEMBL28429123 0.71 PPARG (0.51) MRGPRX4PPARGPPARAGPR34NR4A2
SCHEMBL29994776 0.71 PPARG (0.51) MRGPRX4PPARGPPARAGPR34NR4A2

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-7728005-B2 Ether derivative AJINOMOTO CO., INC. (JP) 2010-06-01 US disclosed
US-20060270693-A1 Ether derivative AJINOMOTO CO., INC. (JP) 2006-11-30 US disclosed
EP-1679296-A1 ETHER DERIVATIVE Ajinomoto Co., Inc. (JP) 2006-07-12 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-20060270693-A1 Ether derivative UROD, IL5, IL17A MRGPRX4 1556/4885ADAMTS4 3574/4885PPARG 159/4885

“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.