SCHEMBL1807955

SCHEMBL1807955

Nc1cccc2cc(S(N)(=O)=O)ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
HSD17B10 Q99714 3/20 0.52
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
ATIC P31939 1/20 0.52
CA2 P00918 10/20 0.52
CA1 P00915 9/20 0.52
CA9 Q16790 9/20 0.50
CA12 O43570 8/20 0.50
CA4 P22748 5/20 0.50
CA14 Q9ULX7 5/20 0.50
CA6 P23280 4/20 0.48
CA5A P35218 4/20 0.48
CA7 P43166 4/20 0.48
CA5B Q9Y2D0 4/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL1804799 0.85 LMNA (0.58) LMNAHSD17B10CYP2C9CYP2C19CA2
SCHEMBL157169 0.84 ALDH1A1 (0.62) HSD17B10CYP2C9CYP2C19ATICMEN1
SCHEMBL29518641 0.84 ALDH1A1 (0.62) HSD17B10CYP2C9CYP2C19ATICMEN1
SCHEMBL3246905 0.84 HSD17B10 (0.51) LMNAHSD17B10CYP2C9CYP2C19ATIC
SCHEMBL28471752 0.84 HSD17B10 (0.51) LMNAHSD17B10CYP2C9CYP2C19ATIC
SCHEMBL4311014 0.84 HSD17B10 (0.51) LMNAHSD17B10CYP2C9CYP2C19ATIC
SCHEMBL29941351 0.84 ALDH1A1 (0.62) HSD17B10CYP2C9CYP2C19ATICMEN1
SCHEMBL28471751 0.82 ALDH1A1 (0.60) HSD17B10CYP2C9CYP2C19ATICMEN1
SCHEMBL3246907 0.82 ALDH1A1 (0.60) HSD17B10CYP2C9CYP2C19ATICMEN1
Water SCHEMBL7704455 0.82 ALDH1A1 (0.60) HSD17B10CYP2C9CYP2C19ATICMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1994385-B1 CHANGED CONDITION INDICATOR COOPERMAN ISADORE (US) 2019-08-14 EP disclosed
US-8404036-B2 Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-26 US disclosed
US-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-05-26 US disclosed
US-7770534-B2 Changed condition indicator THERMOPROX 2010-08-10 US disclosed
EP-1994385-A2 CHANGED CONDITION INDICATOR Cooperman, Isadore (US) 2008-11-26 EP disclosed
US-7338963-B2 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-03-04 US disclosed
US-7338963-B2 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-03-04 US disclosed
WO-2007106463-A2 CHANGED CONDITION INDICATOR COOPERMAN ISADORE (US) 2007-09-20 WO disclosed
US-20070151502-A1 Changed condition indicator THERMOPROX 2007-07-05 US disclosed
US-5530105-A INK JET PRINTING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0645436-A1 Tetrakisazo compound and ink containing the compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-29 EP 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-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME IK, RB1, COL1A1 LMNA 1431/4885HSD17B10 2848/4885CYP2C9 692/4885

“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.