SCHEMBL9837054

SCHEMBL9837054

Oc1ccccc1C1(c2ccccc2O)CC(c2ccccc2O)(c2ccccc2O)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
ALOX15 P16050 3/20 0.45
CA2 P00918 3/20 0.45
LMNA P02545 3/20 0.45
HPGD P15428 3/20 0.45
HSD17B10 Q99714 3/20 0.45
EGFR P00533 2/20 0.45
FYN P06241 2/20 0.45
MMP9 P14780 2/20 0.45
RECQL P46063 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
KDM4E B2RXH2 2/20 0.45
NPC1 O15118 2/20 0.45
MAPT P10636 2/20 0.45
CA4 P22748 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CA12 O43570 1/20 0.45
GMNN O75496 1/20 0.45
POLB P06746 1/20 0.45
CA3 P07451 1/20 0.45

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
SCHEMBL10515528 0.92 ALDH1A1 (0.43) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL9327102 0.86 ALDH1A1 (0.47) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL10514967 0.86 ALDH1A1 (0.47) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL29415365 0.82 ESR1 (0.44) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL444739 0.82 ESR1 (0.44) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL10513090 0.82 ALDH1A1 (0.43) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL31490381 0.80 ESR1 (0.46) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL379394 0.80 ESR1 (0.46) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL9838331 0.80 ESR1 (0.43) ALDH1A1ALOX15CA2LMNAHPGD
SCHEMBL2640042 0.80 ESR1 (0.46) ALDH1A1ALOX15CA2LMNAHPGD

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
EP-0344165-B1 THERMOSET POLYMERS OF STYRENE TERMINATED TETRAKIS PHENOLS AlliedSignal Inc. (US) 1991-09-25 EP disclosed
EP-0344165-A1 THERMOSET POLYMERS OF STYRENE TERMINATED TETRAKIS PHENOLS. ALLIED CORP (US) 1989-12-06 EP disclosed
US-4786700-A PREPARED FROM STYRENE TERMINATED TETRAKISPHENOLS, CIRCUIT BOARDS ALLIED-SIGNAL, INC. (US) 1988-11-22 US disclosed
WO-1988005059-A1 THERMOSET POLYMERS OF STYRENE TERMINATED TETRAKIS PHENOLS ALLIED CORPORATION (US) 1988-07-14 WO disclosed
US-4728708-A Thermoset polymers of styrene terminated tetrakis phenols ALLIED CORPORATION (US) 1988-03-01 US disclosed