SCHEMBL983836

SCHEMBL983836

CCCCCCC(CC)c1ccccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
CYSLTR2 Q9NS75 1/20 0.44
CYSLTR1 Q9Y271 1/20 0.44
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
NR1I2 O75469 1/20 0.42
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
NAAA Q02083 1/20 0.40
CSNK1E P49674 1/20 0.40
CNR2 P34972 1/20 0.39
LMNA P02545 1/20 0.38
PPARG P37231 2/20 0.37

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
SCHEMBL31170722 1.00 TSHR (0.52) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL983627 1.00 TSHR (0.52) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL2865636 1.00 TSHR (0.52) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL984314 1.00 TSHR (0.52) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL109547 1.00 TSHR (0.52) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL984540 1.00 TSHR (0.52) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL981301 0.98 TSHR (0.53) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL32668975 0.98 TSHR (0.53) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL984167 0.93 TSHR (0.50) TSHRCYSLTR2CYSLTR1GABRA1GABRB2
SCHEMBL983265 0.93 TSHR (0.50) TSHRCYSLTR2CYSLTR1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107266338-B The manufacturing method of isocyanates 旭化成株式会社 2019-10-11 CN disclosed
EP-2275405-B1 PROCESS FOR PRODUCING ISOCYANATE USING DIARYL CARBONATE ASAHI CHEMICAL IND (JP) 2019-04-24 EP disclosed
EP-2275406-B1 PROCESS FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2018-11-28 EP disclosed
EP-2792673-B1 Carbamic acid ester derivatives for the production of isocyanate and aromatic hydroxy compounds ASAHI CHEMICAL IND (JP) 2018-07-25 EP disclosed
EP-3099654-B1 SYNTHETIC METHOD UNIV COURT UNIV ST ANDREWS (GB) 2018-05-09 EP disclosed
US-9908826-B2 Synthetic method UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2018-03-06 US disclosed
US-20170174608-A1 Synthetic Method UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2017-06-22 US disclosed
US-9637445-B2 Isocyanate production process using composition containing carbamic acid ester and aromatic hydroxy compound, and composition for transfer and storage of carbamic acid ester ASAHI KASEI CHEMICALS CORPORATION (JP) 2017-05-02 US disclosed
EP-2147909-B1 METHOD FOR PRODUCTION OF ISOCYANATE USING COMPOSITION COMPRISING CARBAMIC ACID ESTER AND AROMATIC HYDROXY COMPOUND, AND COMPOSITION FOR TRANSPORT OR STORAGE OF CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2016-12-14 EP disclosed
EP-3099654-A1 SYNTHETIC METHOD University Court of The University of St Andrews (GB) 2016-12-07 EP disclosed
EP-0279261-A2 Particle-shaped multiphase polymerisates BAYER AG (DE) 1988-08-24 EP disclosed
EP-0272441-A2 Polymer powder containing silicone rubber, its preparation and use as a flame-retardant additive BAYER AG (DE) 1988-06-29 EP disclosed
EP-0260559-A2 Non-aging thermoplastic moulding compositions with an enhanced degree of toughness at a low temperature BAYER AG (DE) 1988-03-23 EP disclosed
EP-0260558-A2 Non-aging thermoplastic moulding composition with a good degree of toughness BAYER AG (DE) 1988-03-23 EP disclosed
EP-0143877-B1 STABLE SILICONE EMULSIONS BAYER AG (DE) 1988-03-23 EP disclosed
EP-0258746-A2 Grafted siloxane elastomers having a notch impact resistance BAYER AG (DE) 1988-03-09 EP disclosed
US-4714691-A Heterogeneous catalyst process ETHYL CORPORATION (US) 1987-12-22 US disclosed
EP-0217257-A2 Diorganosiloxane polymer powder BAYER AG (DE) 1987-04-08 EP disclosed
US-4631349-A RESIN-BONDED ALUMINUM PHENOXIDE CATALYST TO ALKYLATE PHENOLS ETHYL CORPORATION (US) 1986-12-23 US disclosed
EP-0143877-A1 Stable silicone emulsions BAYER AG (DE) 1985-06-12 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-20170174608-A1 Synthetic Method SQLE, FDFT1, CYP51A1 TSHR 4021/4885CYSLTR2 108/4885CYSLTR1 175/4885

“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.