SCHEMBL3146459

SCHEMBL3146459

CC(CC(c1ccc(O)c(C2CCCCC2)c1)c1ccc(O)c(C2CCCCC2)c1)c1ccc(O)c(C2CCCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.47
BACE1 P56817 1/20 0.47
HSP90AA1 P07900 1/20 0.43
THRB P10828 3/20 0.39
ACMSD Q8TDX5 2/20 0.36
APP P05067 1/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
PTGDR2 Q9Y5Y4 4/20 0.35
PTGDR Q13258 1/20 0.35
THRA P10827 2/20 0.34
ADRB2 P07550 1/20 0.34
LNPEP Q9UIQ6 1/20 0.32
HIF1A Q16665 1/20 0.32
HDAC4 P56524 1/20 0.32

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
SCHEMBL10766332 0.99 NUDT1 (0.44) NUDT1BACE1HSP90AA1THRBACMSD
SCHEMBL3178564 0.90 NUDT1 (0.53) NUDT1BACE1HSP90AA1THRBACMSD
SCHEMBL14255665 0.86 NUDT1 (0.40) NUDT1BACE1HSP90AA1THRBACMSD
SCHEMBL11873210 0.85 GAA (0.51) NUDT1BACE1HSP90AA1THRBHSD17B10
SCHEMBL11876985 0.85 GAA (0.51) NUDT1BACE1HSP90AA1THRBHSD17B10
SCHEMBL4061776 0.84 NUDT1 (0.50) NUDT1BACE1HSP90AA1THRBACMSD
SCHEMBL8503276 0.83 NUDT1 (0.47) NUDT1BACE1HSP90AA1THRBHSD17B10
SCHEMBL12526577 0.82 NUDT1 (0.40) NUDT1BACE1HSP90AA1THRBACMSD
SCHEMBL9807722 0.82 NUDT1 (0.49) NUDT1BACE1HSP90AA1THRBACMSD
SCHEMBL10347780 0.82 NUDT1 (0.51) NUDT1BACE1HSP90AA1THRBACMSD

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4774367-A PHENOLIC DYE DEVELOPER ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1988-09-27 US claimed
JP-3173688-A None JP disclosed
EP-3031611-B1 THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LTD (JP) 2017-09-27 EP disclosed
EP-3031611-A1 THERMAL RECORDING MATERIAL Mitsubishi Paper Mills Limited (JP) 2016-06-15 EP disclosed
EP-2096149-B1 INK FOR SCRATCH COLORING AND SHEET WITH INVISIBLE INFORMATION PRINTED MITSUBISHI PAPER MILLS LTD (JP) 2014-10-22 EP disclosed
EP-1260498-B1 NOVEL COLOR FORMER AND RECORDING MATERIAL CHEMIPRO KASEI KAISHA LTD (JP) 2014-07-09 EP disclosed
US-8283285-B2 Scratch color-developable ink and invisible information printed sheet MITSUBISHI PAPER MILLS LIMITED (JP) 2012-10-09 US disclosed
US-7807738-B2 Compound for color-producing composition, and recording material CHEMIPRO KASEI KAISHA, LTD. (JP) 2010-10-05 US disclosed
US-20100105941-A1 NOVEL COMPOUND FOR COLOR-PRODUCING COMPOSITION, AND RECORDING MATERIAL KABASHIMA KAZUO 2010-04-29 US disclosed
EP-1116713-B1 COLOR-DEVELOPING COMPOUND AND RECORDING MATERIAL CHEMIPRO KASEI KAISHA LTD (JP) 2010-02-17 EP disclosed
EP-0535887-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1995-07-19 EP disclosed
EP-0620122-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1994-10-19 EP disclosed
US-5256618-A Using a sulfonylurea or -thiourea-type developer and leuco dye. resistance to oil and fats, e.g, plasticizer, moisture and heat; colorfastness; storage stability; thermography OJI PAPER CO., LTD. (JP) 1993-10-26 US disclosed
US-5246906-A Sulfonyl-urea or -thiourea color developer, oil and plasticizer resistant, storage stable OJI PAPER CO., LTD. (JP) 1993-09-21 US disclosed
EP-0535887-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1993-04-07 EP disclosed
EP-0526072-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1993-02-03 EP disclosed
JP-H03173688-A THERMOSENSITIVE RECORDING MATERIAL OJI PAPER CO LTD 1991-07-26 JP disclosed
EP-0230961-B1 PHENOL COMPOUND AND HEAT-SENSITIVE RECORDING MATERIAL ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1990-06-27 EP disclosed
US-4774367-A PHENOLIC DYE DEVELOPER ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1988-09-27 US disclosed
EP-0230961-A2 Phenol compound and heat-sensitive recording material ADEKA ARGUS CHEMICAL CO., Ltd. (JP) 1987-08-05 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-20100105941-A1 NOVEL COMPOUND FOR COLOR-PRODUCING COMPOSITION, AND RECORDING MATERIAL UMPS, UROD, UGP2 NUDT1 308/4885BACE1 2061/4885HSP90AA1 4759/4885

“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.