SCHEMBL1807436

SCHEMBL1807436

[NH]Cc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
TSHR P16473 3/20 0.50
ALDH1A1 P00352 3/20 0.50
NT5E P21589 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 2/20 0.45
POLB P06746 1/20 0.42
CYP2D6 P10635 1/20 0.42
CA2 P00918 7/20 0.40
CA1 P00915 5/20 0.40
CA12 O43570 4/20 0.40
CA4 P22748 4/20 0.40
CA6 P23280 4/20 0.40
CA5A P35218 4/20 0.40
CA7 P43166 4/20 0.40
CA9 Q16790 4/20 0.40
CA14 Q9ULX7 4/20 0.40
CA5B Q9Y2D0 4/20 0.40
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 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
SCHEMBL1806675 0.82 LMNA (0.48) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL11583429 0.80 LMNA (0.56) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL9619529 0.80 LMNA (0.56) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL8386014 0.79 LMNA (0.50) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL150334 0.79 LMNA (0.77) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL1804523 0.79 CA2 (0.47) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL1804224 0.78 LMNA (0.54) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL505826 0.78 CA2 (0.64) LMNATSHRALDH1A1NT5ESMN1; SMN2
Hydrochloric Acid SCHEMBL7261261 0.78 LMNA (0.54) LMNATSHRALDH1A1NT5ESMN1; SMN2
SCHEMBL1807217 0.77 CA2 (0.49) LMNATSHRALDH1A1NT5ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20110216117-A1 WATER-SOLUBLE AZO COMPOUND OR SALT THEREOF, INK COMPOSITION, AND COLORED MATTER NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-09-08 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-4332938-A Anthaquinone reactive dyestuffs, their preparation and their use for dyeing materials containing OH groups or amide groups BAYER AKTIENGESELLSCHAFT (DE) 1982-06-01 US disclosed
US-4325705-A Anthraquinone reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1982-04-20 US disclosed
EP-0012341-A1 Anthraquinone reactive dyestuffs and their use in dyeing materials that contain hydroxyl or amide groups BAYER AG (DE) 1980-06-25 EP disclosed
EP-0012342-A1 Anthraquinone reactive dyestuffs and their use in dyeing and printing materials that contain hydroxyl groups or amide groups BAYER AG (DE) 1980-06-25 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 1431/4885TSHR 3565/4885ALDH1A1 218/4885

“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.