SCHEMBL1805992

SCHEMBL1805992

[NH]C(=O)c1ccc(Cl)c(S(=O)(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CA1 P00915 5/20 0.41
CA2 P00918 5/20 0.41
MEN1 O00255 1/20 0.41
NPBWR1 P48145 1/20 0.41
MCHR1 Q99705 1/20 0.41
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP1A2 P05177 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 1/20 0.40
MMP2 P08253 2/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL250653 0.85 MMP2 (0.51) TDP1KMT2ASMN1; SMN2CA1CA2
SCHEMBL1807551 0.84 CA1 (0.57) CA1CA2MMP2
SCHEMBL2572655 0.83 MMP2 (0.50) TDP1KMT2ASMN1; SMN2CA1CA2
SCHEMBL2780755 0.83 TDP1 (0.61) TDP1KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL4365592 0.83 MMP2 (0.50) TDP1KMT2ASMN1; SMN2CA1CA2
SCHEMBL4365596 0.83 MMP2 (0.50) TDP1KMT2ASMN1; SMN2CA1CA2
SCHEMBL1805995 0.81 PARP1 (0.48) TDP1KMT2ASMN1; SMN2CA1CA2
SCHEMBL250228 0.79 MMP2 (0.50) TDP1KMT2AMEN1MMP2MAPK1
SCHEMBL1804204 0.78 SMN1; SMN2 (0.43) TDP1SMN1; SMN2ALDH1A1L3MBTL1POLB
SCHEMBL5082270 0.77 MMP2 (0.49) TDP1KMT2AMEN1MMP2MAPK1

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 2 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-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-05-26 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-20110123784-A1 WATER-SOLUBLE NEAR-INFRARED ABSORBING COLORING MATTERS AND AQUEOUS INKS CONTAINING SAME IK, RB1, COL1A1 TDP1 3524/4885KMT2A 1224/4885SMN1; SMN2 1683/4885

“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.