SCHEMBL6522697

SCHEMBL6522697

Cc1ccc(S(=O)(=O)c2ccc(S(=O)(=O)c3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
PTPRC P08575 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
RXFP1 Q9HBX9 1/20 0.48
VDR P11473 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CDK2 P24941 1/20 0.46
PGAM1 P18669 1/20 0.46
MAPT P10636 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
USP2 O75604 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
NOD2 Q9HC29 1/20 0.45
ELANE P08246 1/20 0.44

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
SCHEMBL10797263 0.91 ADORA2A (0.56) GAAALDH1A1KDM4EPTPRCNPSR1
SCHEMBL10797240 0.86 CDK2 (0.46) GAAALDH1A1KDM4EPTPRCNPSR1
SCHEMBL10803211 0.85 P2RY4 (0.54) GAAALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL10802520 0.85 GRM5 (0.46) GAAALDH1A1KDM4EPTPRCNPSR1
SCHEMBL10802535 0.83 ALDH1A1 (0.56) GAAALDH1A1KDM4ENPSR1SMN1; SMN2
SCHEMBL10803734 0.83 POLB (0.45) GAAALDH1A1KDM4ERXFP1HTT
SCHEMBL11066315 0.81 KMT2A (0.53) GAAALDH1A1KDM4EPTPRCNPSR1
SCHEMBL10818142 0.80 POLB (0.42) GAAALDH1A1KDM4ENPSR1RXFP1
SCHEMBL31000980 0.78 GAA (0.68) GAAALDH1A1KDM4ENPSR1RXFP1
SCHEMBL11853033 0.78 GAA (0.68) GAAALDH1A1KDM4ENPSR1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8206464-B2 Blue polymeric hair dyes BASF SE (DE) 2012-06-26 US disclosed
US-20110061179-A1 BLUE POLYMERIC HAIR DYES BASF SE (US) 2011-03-17 US disclosed
US-4661293-A Method for preparing 1,4-diaminoanthraquinones and intermediates thereof THE CLOROX COMPANY (US) 1987-04-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110061179-A1 BLUE POLYMERIC HAIR DYES CUTA, IK, TYR GAA 3048/4885ALDH1A1 2076/4885KDM4E 182/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.