SCHEMBL8219777

SCHEMBL8219777

CCC=CC=C(C(=O)O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.49
▸ POLB P06746 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ HPGD P15428 3/20 0.46
▸ ALDH1A1 P00352 5/20 0.45
▸ KDM4E B2RXH2 2/20 0.43
▸ AGTR1 P30556 1/20 0.43
▸ ERCC5 P28715 1/20 0.42
▸ FEN1 P39748 1/20 0.42
▸ HAO1 Q9UJM8 1/20 0.42
▸ USP2 O75604 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ RAB9A P51151 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ GPR52 Q9Y2T5 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
SCHEMBL8162556 0.90 AKR1C1 (0.47) MAPTSMN1; SMN2L3MBTL1POLBMEN1
SCHEMBL8162561 0.90 AKR1C1 (0.47) MAPTSMN1; SMN2L3MBTL1POLBMEN1
SCHEMBL8214861 0.88 SMN1; SMN2 (0.47) MAPTSMN1; SMN2L3MBTL1POLBMEN1
SCHEMBL8215241 0.82 POLB (0.50) MAPTSMN1; SMN2L3MBTL1POLBMEN1
SCHEMBL8215469 0.79 GSK3B (0.41) MAPTL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL10765334 0.78 AKR1C1 (0.44) MAPTMEN1KMT2AALDH1A1PTPN1
SCHEMBL10765330 0.78 AKR1C1 (0.44) MAPTMEN1KMT2AALDH1A1PTPN1
SCHEMBL8894614 0.76 POLB (0.57) MAPTSMN1; SMN2L3MBTL1POLBMEN1
SCHEMBL8220602 0.76 KMT2A (0.39) MAPTSMN1; SMN2POLBMEN1KMT2A
SCHEMBL23079029 0.75 ERCC5 (0.45) SMN1; SMN2MEN1KMT2AHPGDERCC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6106908-A OPTICAL APPARATUS WITH LIQUID CRYSTAL COMPOUNDS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 2000-08-22 — — US disclosed
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