SCHEMBL931608

SCHEMBL931608

CCCCCOc1ccc(S(=O)(=O)c2ccc(OCCCCC)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.68
CA12 O43570 3/20 0.68
CA1 P00915 3/20 0.68
CA2 P00918 3/20 0.68
CA9 Q16790 3/20 0.68
CA7 P43166 2/20 0.68
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
MAPK1 P28482 1/20 0.59
RECQL P46063 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
NR5A1 Q13285 1/20 0.56
LTA4H P09960 3/20 0.55
TP53 P04637 1/20 0.54
PLA2G4B P0C869 1/20 0.53
GAA P10253 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MMP1 P03956 2/20 0.51
ADAMTS4 O75173 1/20 0.51
MMP2 P08253 1/20 0.51

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
SCHEMBL13900197 0.98 TSHR (0.66) TSHRCA12CA1CA2CA9
SCHEMBL4274294 0.98 TSHR (0.66) TSHRCA12CA1CA2CA9
SCHEMBL9616788 0.98 TSHR (0.66) TSHRCA12CA1CA2CA9
SCHEMBL10013797 0.98 TSHR (0.66) TSHRCA12CA1CA2CA9
SCHEMBL3625442 0.98 TSHR (0.66) TSHRCA12CA1CA2CA9
SCHEMBL930267 0.96 CA12 (0.72) TSHRCA12CA1CA2CA9
SCHEMBL14435298 0.92 PKM (0.61) TSHRCA12CA1CA2CA9
SCHEMBL9868701 0.92 TSHR (0.58) TSHRCA12CA1CA2CA9
SCHEMBL6686535 0.92 NR5A1 (0.72) TSHRCA12CA1CA2CA9
SCHEMBL4264624 0.90 NR5A1 (0.75) TSHRCA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0542556-B1 Thermosensitive recording material NEW OJI PAPER CO LTD (JP) 1995-07-19 EP claimed
US-5314859-A Thermosensitive recording material OJI PAPER CO., LTD. (JP) 1994-05-24 US claimed
EP-0542556-A1 Thermosensitive recording material NEW OJI PAPER CO., LTD. (JP) 1993-05-19 EP claimed
US-4590498-A HEAT AND PRESSURE SENESITIVE ELEMENTS; HIGH SPEED; FLORAN DYES; INTENSITY SHIN NISSO KAKO CO., LTD. (JP) 1986-05-20 US claimed
JP-60047070-A None JP disclosed
US-11529819-B2 Recording material and compound NIPPON SODA CO., LTD. (JP) 2022-12-20 US disclosed
US-20210060994-A1 HEAT SENSITIVE RECORDING MATERIAL WITH NON-PHENOLIC COLOR DEVELOPERS BASF SE (DE) 2021-03-04 US disclosed
EP-3263553-B1 CRYSTALLINE MODIFICATION OF N-(2-(3-PHENYLUREIDO)PHENYL)BENZENESULFONAMIDE AND RECORDING MATERIAL USING SAME NIPPON SODA CO (JP) 2020-12-09 EP disclosed
EP-3636446-A1 RECORDING MATERIAL AND COMPOUND Nippon Soda Co., Ltd. (JP) 2020-04-15 EP disclosed
US-20200086669-A1 RECORDING MATERIAL AND COMPOUND NIPPON SODA CO., LTD. (JP) 2020-03-19 US disclosed
EP-2484663-B1 PHENOLIC COMPOUND AND RECORDING MATERIAL NIPPON SODA CO (JP) 2019-07-17 EP disclosed
EP-2923851-B1 RECORDING MATERIAL PRODUCED USING NON-PHENOL COMPOUND NIPPON SODA CO (JP) 2019-05-01 EP disclosed
EP-0860429-B1 DIPHENYL SULFONE CROSSLINKING TYPE COMPOUNDS AND RECORDING MATERIALS USING THEM NIPPON SODA CO (JP) 2001-12-12 EP disclosed
US-6143060-A EXCELLENT IN THE STORAGE STABILITY OF DEVELOPED IMAGES, PARTICULARLY THE RESISTANCE THEREOF TO PLASTICIZERS NIPPON SODA CO., LTD. (JP) 2000-11-07 US disclosed
US-6037308-A HIGH RECORDED IMAGE PRESERVABILITY NIPPON SODA CO., LTD. (JP) 2000-03-14 US disclosed
EP-0906908-A1 TRIAZINE DERIVATIVES AND RECORDING MATERIALS PREPARED THEREFROM NIPPON SODA CO., LTD. (JP) 1999-04-07 EP disclosed
EP-0131631-B1 HEAT-SENSITIVE RECORDING PAPER Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-11-02 EP disclosed
US-4605940-A CONTAINING A PHENOLIC COMPOUND AND AN AROMATIC DIETHER SULFONE YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1986-08-12 US disclosed
JP-S6047070-A 4,4-DI-N-PENTYLOXYDIPHENYL SULFONE SHIN NISSO KAKO CO LTD 1985-03-14 JP disclosed
EP-0131631-A1 HEAT-SENSITIVE RECORDING PAPER Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1985-01-23 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 (2 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-11529819-B2 Recording material and compound H1-0, DOT1L, H1-4 TSHR 4114/4885CA12 419/4885CA1 89/4885
US-20200086669-A1 RECORDING MATERIAL AND COMPOUND H1-0, DOT1L, H1-4 TSHR 4114/4885CA12 419/4885CA1 89/4885

“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.