SCHEMBL1804053

SCHEMBL1804053

C[N]c1ccc(S(=O)(=O)O)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.49
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ SENP2 Q9HC62 4/20 0.40
▸ SENP1 Q9P0U3 3/20 0.40
▸ SUMO2 P61956 3/20 0.40
▸ SUMO1 P63165 3/20 0.40
▸ SENP7 Q9BQF6 3/20 0.40
▸ SENP3 Q9H4L4 2/20 0.39
▸ PHLPP2 Q6ZVD8 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ ATIC P31939 1/20 0.36
▸ RAD1 O60671 1/20 0.36
▸ P2RY6 Q15077 1/20 0.36
▸ TP53 P04637 2/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ RECQL P46063 2/20 0.34

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
SCHEMBL27519221 0.85 BRD4 (0.49) BRD4L3MBTL1SENP2SENP1SUMO2
SCHEMBL1803018 0.85 BRD4 (0.45) BRD4L3MBTL1SENP2SENP1SUMO2
SCHEMBL11499546 0.83 BRD4 (0.47) BRD4L3MBTL1SENP2SENP1SUMO2
SCHEMBL1806623 0.79 PTGS1 (0.36) BRD4L3MBTL1ALDH1A1RAD1P2RY6
SCHEMBL1803312 0.77 PTGS2 (0.44) BRD4L3MBTL1PHLPP2ALDH1A1TP53
SCHEMBL158650 0.76 L3MBTL1 (0.68) BRD4L3MBTL1SENP2SENP1SUMO2
SCHEMBL26645 0.75 MEP1B (0.49) L3MBTL1ALDH1A1TP53MEN1KMT2A
SCHEMBL30508542 0.75 ALDH1A1 (0.42) BRD4L3MBTL1SENP2SENP1SUMO2
SCHEMBL29035724 0.75 ALDH1A1 (0.42) BRD4L3MBTL1SENP2SENP1SUMO2
SCHEMBL29454656 0.75 MEP1B (0.49) L3MBTL1ALDH1A1TP53MEN1KMT2A

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 BRD4 4487/4885L3MBTL1 2085/4885SENP2 2710/4885

“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.

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