SCHEMBL4011093

SCHEMBL4011093

Cc1c(C2(c3ccc(O)c(C(C)C)c3C)OS(=O)(=O)c3ccccc32)ccc(O)c1C(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 1/20 0.61
PTPN11 Q06124 2/20 0.57
CYP3A4 P08684 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPK1 P28482 1/20 0.57
LMNA P02545 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
HIF1A Q16665 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.33
CYP2D6 P10635 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP2C19 P33261 1/20 0.33
PAX8 Q06710 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
POLB P06746 1/20 0.30

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
SCHEMBL3398015 0.78 PTPN11 (0.78) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL3422255 0.76 PTPN11 (0.76) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL29707853 0.76 CDK2 (1.00) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL1554446 0.76 CYP3A4 (0.74) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL41734 0.76 CDK2 (1.00) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL410463 0.76 TDP1 (0.67) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL35729 0.76 CDK2 (0.60) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL11745288 0.75 CYP3A4 (0.73) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL11751903 0.75 CDK2 (0.58) CDK2PTPN11CYP3A4TDP1ALDH1A1
SCHEMBL4634262 0.75 TDP1 (0.65) CDK2PTPN11CYP3A4TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0925501-B1 pH AND AMINE TEST ELEMENTS AND APPLICATIONS TO DIAGNOSIS OF VAGINAL INFECTIONS LITMUS CONCEPTS INC (US) 2009-06-17 EP disclosed
US-20080032411-A1 Iconic Colorimetric Test Device with Reduced Susceptibility To False Positive and False Negative Readings QUIDEL CORPORATION (US) 2008-02-07 US disclosed
US-7255832-B2 Iconic colorimetric test device with reduced susceptibility to false positive and false negative readings QUIDEL CORPORATION (US) 2007-08-14 US disclosed
WO-2005029068-A9 ICONIC COLORIMETRIC TEST DEVICE WITH REDUCED SUSCEPTIBILITY TO FALSE POSITIVE AND FALSE NEGATIVE READINGS QUIDEL CORP (US) 2005-12-08 WO disclosed
US-20050070021-A1 Iconic colorimetric test device with reduced susceptibility to false positive and false negative readings QUIDEL CORPORATION, A DELAWARE CORPORATION (US) 2005-03-31 US disclosed
US-6200817-B1 PH and amine test elements and applications to diagnosis of vaginal infections LITMUS CONCEPTS, INC. 2001-03-13 US disclosed
US-6113856-A Method of making a pH and amine test element LITMUS CONCEPTS, INC. (US) 2000-09-05 US disclosed
US-6099801-A pH and amine test elements and applications to diagnosis of vaginal infections LITMUS CONCEPTS, INC. (US) 2000-08-08 US disclosed
EP-0925501-A1 pH AND AMINE TEST ELEMENTS AND APPLICATIONS TO DIAGNOSIS OF VAGINAL INFECTIONS LITMUS CONCEPTS, INC. (US) 1999-06-30 EP disclosed
US-5910447-A pH and amine test to diagnosis of vaginal infections LITMUS CONCEPTS, INC. (US) 1999-06-08 US disclosed
US-5897834-A pH test elements LITMUS CONCEPTS, INC. (US) 1999-04-27 US disclosed
WO-1998007027-A1 pH AND AMINE TEST ELEMENTS AND APPLICATIONS TO DIAGNOSIS OF VAGINAL INFECTIONS LITMUS CONCEPTS, INC. (US) 1998-02-19 WO disclosed
US-5660790-A PH and amine test elements LITMUS CONCEPTS, INC. (US) 1997-08-26 US disclosed