SCHEMBL4925970

SCHEMBL4925970

O=C(c1ccccc1)C(O)(CCc1ccc(S(=O)(=O)O)cc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
CYP2D6 P10635 2/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SLC13A5 Q86YT5 1/20 0.37
MAPK1 P28482 1/20 0.36
ESRRG P62508 1/20 0.36
PTPN1 P18031 1/20 0.36
CCR2 P41597 1/20 0.36
HTR6 P50406 1/20 0.36
CES1 P23141 1/20 0.36
MMP12 P39900 2/20 0.35
MMP13 P45452 2/20 0.35

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
SCHEMBL27612829 0.80 SMN1; SMN2 (0.50) ALDH1A1TSHRSMN1; SMN2CYP2D6POLB
Methoxymethane SCHEMBL27323620 0.80 CES1 (0.50) ALDH1A1TSHRSLC13A5ESRRGCES1
SCHEMBL504244 0.77 RECQL (0.47) ALDH1A1TSHRSMN1; SMN2CYP2D6POLB
SCHEMBL6929012 0.73 TSHR (0.62) ALDH1A1TSHRSMN1; SMN2CA1CA2
SCHEMBL4056325 0.71 LMNA (0.36) ALDH1A1CA2CYP2D6MEN1KMT2A
SCHEMBL11533981 0.71 NR4A2 (0.47) ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL452703 0.71 CES1 (0.49) ALDH1A1TSHRCYP2D6MEN1KMT2A
SCHEMBL499362 0.70 RECQL (0.46) ALDH1A1TSHRSMN1; SMN2CYP2D6MEN1
SCHEMBL21111342 0.70 SMN1; SMN2 (0.58) ALDH1A1TSHRSMN1; SMN2CA2CYP2D6
SCHEMBL28276274 0.70 SMN1; SMN2 (0.58) ALDH1A1TSHRSMN1; SMN2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070998-A1 Foam Production Method OJI PAPER CO., LTD. (JP) 2008-03-20 US disclosed
EP-1795553-A1 PROCESS FOR PRODUCING FOAM Oji Paper Co., Ltd. (JP) 2007-06-13 EP disclosed