SCHEMBL7929927

SCHEMBL7929927

CCCCOc1c(Nc2cccc(C(=O)OCC)c2)c(OCCCC)c2c(c1OCCCC)C(=O)c1c(O)ccc(O)c1C2=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.55
RAB9A P51151 5/20 0.55
NPC1 O15118 4/20 0.55
HPGD P15428 4/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
CDC25B P30305 5/20 0.48
TP53 P04637 3/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 4/20 0.45
LMNA P02545 3/20 0.45
POLB P06746 2/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
THRB P10828 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
SCHEMBL7927091 0.91 SMN1; SMN2 (0.52) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7929768 0.89 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7933319 0.88 SMN1; SMN2 (0.48) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7921356 0.87 SMN1; SMN2 (0.48) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7930631 0.85 SMN1; SMN2 (0.49) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7930852 0.85 CDC25B (0.48) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7928227 0.84 SMN1; SMN2 (0.48) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7933212 0.82 SMN1; SMN2 (0.54) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7930880 0.81 SMN1; SMN2 (0.47) SMN1; SMN2RAB9ANPC1HPGDCYP1A2
SCHEMBL7921294 0.81 CDC25B (0.56) SMN1; SMN2RAB9ANPC1HPGDCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 EP disclosed
US-5968688-A RESINS AND DYES FOR COLOR FILTERS NIPPON SHOKUBAI CO., LTD. (JP) 1999-10-19 US disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
EP-0833203-A1 Color filter grade photosensitive resin coloring composition, and color filter using the same NIPPON SHOKUBAI CO., LTD. (JP) 1998-04-01 EP disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP disclosed