SCHEMBL8083040

SCHEMBL8083040

CCn1c2ccccc2c2cc([N+]#N)ccc21.O=S(=O)([O-])C(F)(F)C(F)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 2/20 0.44
FDFT1 P37268 2/20 0.42
NPY5R Q15761 1/20 0.42
MAPT P10636 7/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
KDM4E B2RXH2 4/20 0.40
MAPK1 P28482 3/20 0.40
ALDH1A1 P00352 1/20 0.40
HBB P68871 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTGES O14684 1/20 0.38

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
SCHEMBL9631354 0.80 MAPT (0.59) LMNAHPGDHTTNPY5RMAPT
SCHEMBL8670613 0.79 LMNA (0.35) LMNAHPGDHTTFDFT1NPY5R
Hydrochloric Acid SCHEMBL9630379 0.78 MAPT (0.58) LMNAHPGDHTTNPY5RMAPT
SCHEMBL9807629 0.77 MAPT (0.54) LMNAHPGDHTTNPY5RMAPT
Lindane SCHEMBL9754163 0.74 MAPT (0.52) LMNAHPGDHTTMAPTMEN1
SCHEMBL8081792 0.73 PTPN1 (0.33)
SCHEMBL11314712 0.70 KDM4E (0.41) LMNAHPGDHTTNPY5RMAPT
SCHEMBL29952811 0.68 MAPT (0.61) LMNAHPGDHTTNPY5RMAPT
SCHEMBL9631375 0.65 GPR3 (0.57) LMNAHPGDHTTNPY5RMAPT
SCHEMBL9145812 0.65 MAPT (0.57) LMNAHPGDHTTFDFT1MAPT

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
EP-0679635-B1 Aromatic diazonium salts and their use in radiation-sensitive compositions AGFA GEVAERT NV (BE) 2000-09-27 EP disclosed
US-5776652-A Aromatic hexafluoropropanesulfonate diazonium salts and their use in radiation-sensitive mixtures AGFA-GEVAERT AG (DE) 1998-07-07 US disclosed
EP-0679635-A1 Aromatic diazonium salts and their use in radiation-sensitive compositions HOECHST AKTIENGESELLSCHAFT (DE) 1995-11-02 EP disclosed