SCHEMBL1803018

SCHEMBL1803018

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

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.45
▸ GLO1 Q04760 8/20 0.41
▸ POLB P06746 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ RAD1 O60671 1/20 0.39
▸ P2RY6 Q15077 1/20 0.39
▸ SENP2 Q9HC62 4/20 0.39
▸ SUMO2 P61956 3/20 0.39
▸ SUMO1 P63165 3/20 0.39
▸ SENP7 Q9BQF6 3/20 0.39
▸ ATIC P31939 1/20 0.39
▸ SENP1 Q9P0U3 3/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ SENP3 Q9H4L4 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ PHLPP2 Q6ZVD8 1/20 0.36
▸ LMNA P02545 1/20 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
SCHEMBL1804053 0.85 BRD4 (0.49) BRD4GLO1POLBRECQLRAD1
SCHEMBL11390557 0.83 BRD4 (0.44) BRD4GLO1POLBRECQLESR2
SCHEMBL28161117 0.80 BRD4 (0.42) BRD4GLO1POLBRECQLESR2
SCHEMBL9612276 0.79 POLB (0.56) BRD4GLO1POLBSENP2SUMO2
Hydrochloric Acid SCHEMBL11299257 0.79 CYP3A4 (0.54) BRD4GLO1POLBRECQLESR2
SCHEMBL13317163 0.79 POLB (0.56) BRD4GLO1POLBSENP2SUMO2
SCHEMBL1805699 0.78 BRD4 (0.38) BRD4POLBRECQLRAD1P2RY6
SCHEMBL14625742 0.78 BRD4 (0.47) BRD4GLO1POLBRECQLRAD1
SCHEMBL1807377 0.77 SMN1; SMN2 (0.46) POLBRECQLL3MBTL1TP53LMNA
SCHEMBL29648925 0.76 ALDH1A1 (0.54) POLBRECQLESR2SENP2SUMO2

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 4487/4885GLO1 621/4885POLB 3927/4885

“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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