SCHEMBL5044810

SCHEMBL5044810

Bc1cc(C=O)cc(OC)c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.52
▸ TSHR P16473 1/20 0.52
▸ HPGD P15428 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ TRIM24 O15164 1/20 0.47
▸ ALDH5A1 P51649 1/20 0.47
▸ ABAT P80404 1/20 0.47
▸ TRIM33 Q9UPN9 1/20 0.47
▸ MAPK1 P28482 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ HTR2C P28335 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ FDPS P14324 1/20 0.44
▸ CYP1A1 P04798 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP1B1 Q16678 1/20 0.44
▸ LMNA P02545 1/20 0.43

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
SCHEMBL96635 0.87 ALDH1A1 (0.59) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL16619850 0.87 ALDH1A1 (0.59) ALDH1A1TSHRHPGDTDP1TRIM24
Hydrochloric Acid SCHEMBL23711567 0.85 ALDH1A1 (0.57) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL17655658 0.82 ALDH1A1 (0.53) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL24756113 0.81 ALDH1A1 (0.57) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL9888329 0.81 ALDH1A1 (0.53) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL5045277 0.80 FDPS (0.46) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL5045913 0.80 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL26100046 0.80 ALDH1A1 (0.52) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL1766183 0.78 TUBB1 (0.50) ALDH1A1TSHRHPGDTDP1TRIM24

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
WO-2012062905-A2 CHROMENE DERIVATIVES AND THEIR ANALOGA AS WNT PATHWAY ANTAGONISTS DEUTSCHES KREBSFORSCHUNGSZENTRUM (DKFZ) (DE) 2012-05-18 — — WO disclosed
WO-2012062901-A2 CHROMENE DERIVATIVES AND THEIR ANALOGA AS WNT PATHWAY ANTAGONISTS DEUTSCHES KREBSFORSCHUNGSZENTRUM (DKFZ) (DE) 2012-05-18 — — WO disclosed
EP-1392683-B1 SUBSTITUTED 4H-CHROMENES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THEIR USE AS ANTICANCER AGENTS CYTOVIA INC (US) 2009-12-02 — — EP disclosed
WO-2007065032-A2 COMPOUNDS AND METHODS FOR INHIBITING VIRAL ENTRY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-06-07 — — WO disclosed
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