SCHEMBL3307223

SCHEMBL3307223

CC(C)(C)OC(=O)N1CCc2cccc(C(=O)N(C(=O)O)C3Cc4ccccc4C3)c2C1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.43
UCHL1 P09936 1/20 0.43
MAPK1 P28482 1/20 0.43
NR1H2 P55055 1/20 0.43
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
PRMT5 O14744 4/20 0.41
WDR77 Q9BQA1 4/20 0.41
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
USP30 Q70CQ3 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GPR119 Q8TDV5 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
THRB P10828 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
SCHEMBL3311068 0.92 UCHL1 (0.49) ESR2UCHL1MAPK1NR1H2DDB1
SCHEMBL3304095 0.88 NR1D1 (0.42) ESR2UCHL1MAPK1NR1H2TMEM97
SCHEMBL1570606 0.83 ESR2 (0.54) ESR2UCHL1MAPK1NR1H2TMEM97
SCHEMBL29801280 0.83 ESR2 (0.54) ESR2UCHL1MAPK1NR1H2TMEM97
SCHEMBL14904850 0.80 ESR2 (0.47) ESR2UCHL1MAPK1NR1H2TMEM97
SCHEMBL3309743 0.80 UCHL1 (0.44) ESR2UCHL1MAPK1NR1H2DDB1
SCHEMBL25107642 0.80 ESR2 (0.51) ESR2UCHL1MAPK1NR1H2TMEM97
SCHEMBL14895889 0.79 ESR2 (0.53) ESR2UCHL1MAPK1NR1H2TMEM97
SCHEMBL19739032 0.77 ESR2 (0.51) ESR2UCHL1MAPK1NR1H2TMEM97
SCHEMBL14868188 0.76 ESR2 (0.50) ESR2UCHL1MAPK1NR1H2TMEM97

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-8569535-B2 Substituted benzoylamino-indan-2-carboxylic acids and related compounds SANOFI (FR) 2013-10-29 US disclosed
US-20100113462-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS SANOFI-AVENTIS (FR) 2010-05-06 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-20100113462-A1 SUBSTITUTED BENZOYLAMINO-INDAN-2-CARBOXYLIC ACIDS AND RELATED COMPOUNDS CXCR5, CXCR1, CCR5 ESR2 663/4885UCHL1 4176/4885MAPK1 1056/4885

“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.