SCHEMBL13178293

SCHEMBL13178293

O=C(Cc1ccccc1)c1ccc(I)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
SRD5A2 P31213 2/20 0.65
STS P08842 1/20 0.54
PDPK1 O15530 1/20 0.51
RAB9A P51151 2/20 0.50
PLAU P00749 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TPMT P51580 1/20 0.50
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
AKR1B1 P15121 1/20 0.50
S1PR5 Q9H228 1/20 0.50
GAA P10253 1/20 0.49
PPARG P37231 1/20 0.48
PPARA Q07869 1/20 0.48
KMT2A Q03164 1/20 0.46

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
SCHEMBL11781277 0.92 MAPT (0.56) MAPTL3MBTL1SRD5A2STSPDPK1
SCHEMBL7129800 0.89 MAPT (0.80) MAPTL3MBTL1SRD5A2STSRAB9A
SCHEMBL24800 0.85 MAPT (0.73) MAPTL3MBTL1SRD5A2STSRAB9A
SCHEMBL8033816 0.83 SRD5A2 (0.89) MAPTL3MBTL1SRD5A2STSRAB9A
SCHEMBL5260372 0.83 SRD5A2 (0.89) MAPTL3MBTL1SRD5A2STSRAB9A
Bicarbonate SCHEMBL28984888 0.83 MAPT (0.70) MAPTL3MBTL1SRD5A2STSRAB9A
SCHEMBL4282905 0.83 MAPT (0.70) MAPTL3MBTL1SRD5A2STSRAB9A
Water SCHEMBL20527670 0.83 MAPT (0.70) MAPTL3MBTL1SRD5A2STSRAB9A
Hydrochloric Acid SCHEMBL27315608 0.83 MAPT (0.70) MAPTL3MBTL1SRD5A2STSRAB9A
Water SCHEMBL9243001 0.83 MAPT (0.70) MAPTL3MBTL1SRD5A2STSRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853423-B2 Indane estrogen receptor modulators and uses thereof SERAGON PHARMACEUTICALS, INC. (US) 2014-10-07 US disclosed
US-20130137746-A1 INDANE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ARAGON PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
EP-1501819-B1 ESTROGEN RECEPTOR MODULATORS MERCK SHARP & DOHME (US) 2010-09-15 EP disclosed
CN-1303851-A Synthesis method of idocifen SHANGHAI RES INST OF PHARMACEU (CN) 2001-07-18 CN 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-20130137746-A1 INDANE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF GPER1, ESR2, ESR1 MAPT 2559/4885L3MBTL1 4840/4885SRD5A2 93/4885

“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.