SCHEMBL13724159

SCHEMBL13724159

CCCCC(CC)Cc1cc(I)sc1Br

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TSHR P16473 2/20 0.33
▸ CYP3A4 P08684 2/20 0.33
▸ GLA P06280 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CA2 P00918 1/20 0.30

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
SCHEMBL22075926 0.84 ALDH1A1 (0.36) ALDH1A1TDP1TSHRCYP3A4GLA
SCHEMBL14217354 0.79 ALDH1A1 (0.33) ALDH1A1TDP1TSHRCYP3A4GLA
SCHEMBL18041178 0.78 TSHR (0.35) ALDH1A1TDP1TSHRCYP3A4GLA
SCHEMBL3466354 0.77 BDKRB2 (0.36) ALDH1A1TSHRGLAHTTL3MBTL1
SCHEMBL13724160 0.77 — —
SCHEMBL1261390 0.75 ALDH1A1 (0.42) ALDH1A1TDP1TSHRCYP3A4GLA
SCHEMBL1040922 0.75 ALDH1A1 (0.42) ALDH1A1TDP1TSHRCYP3A4GLA
SCHEMBL15738357 0.75 ALDH1A1 (0.42) ALDH1A1TDP1TSHRCYP3A4GLA
SCHEMBL28486437 0.74 ALDH1A1 (0.32) ALDH1A1TDP1
SCHEMBL18985155 0.72 SMN1; SMN2 (0.33) ALDH1A1HTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140166942-A1 BLOCK COPOLYMER AND PHOTOELECTRIC CONVERSION ELEMENT KURARAY CO., LTD. (JP) 2014-06-19 — — US disclosed
US-20140084220-A1 PI-ELECTRON CONJUGATED BLOCK COPOLYMER AND PHOTOELECTRIC CONVERSION ELEMENT KURARAY CO., LTD. (JP) 2014-03-27 — — US disclosed
EP-2706077-A1 ELECTRON CONJUGATED BLOCK COPOLYMER AND PHOTOELECTRIC CONVERSION ELEMENT Kuraray Co., Ltd. (JP) 2014-03-12 — — EP disclosed
EP-2692760-A1 BLOCK COPOLYMER AND PHOTOELECTRIC CONVERSION ELEMENT Kuraray Co., Ltd. (JP) 2014-02-05 — — EP disclosed
WO-2012148942-A1 PRODUCTION METHOD OF ORGANIC PHOTOVOLTAIC ELEMENT KURARAY CO., LTD. (JP) 2012-11-01 — — WO disclosed
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